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Structure

2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one

CAS
122852-75-9
Catalog Number
ACM122852759
Category
Other Products
Molecular Weight
200.24
Molecular Formula
C12H12N2O

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Specification

Synonyms
2,3,4,5-TETRAHYDRO-5-METHYL-1H-PYRIDO[4,3-B]INDOL-1-ONE;1H-PYRIDO[4,3-B]INDOL-1-ONE, 2,3,4,5-TETRAHYDRO-5-METHYL-;2,3,4,5-TETRA-HYDRO-5-METHYL-1H-PYRIDO[4,3-B]INDOL-1-ONE(ETHAMBUTOL);Alosetron InterMediates;N-(4-Methyl-2,3-dihydrocyclopenta[b]indol-1-ylidene)hydroxylaMine;5-Methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-1-one
What is the molecular formula of 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

The molecular formula is C12H12N2O.

What is the molecular weight of 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

The molecular weight is 200.24 g/mol.

What is the IUPAC name of 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

The IUPAC name is 5-methyl-3,4-dihydro-2H-pyrido[4,3-b]indol-1-one.

What is the Canonical SMILES representation of 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

CN1C2=C(C3=CC=CC=C31)C(=O)NCC2.

What is the InChIKey of 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

The InChIKey is GLHMAFAXJJECMG-UHFFFAOYSA-N.

What is the XLogP3-AA value for 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

The XLogP3-AA value is 1.3.

How many hydrogen bond donor counts are there in 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

There is 1 hydrogen bond donor count.

What is the topological polar surface area of 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

The topological polar surface area is 34 Å2.

Is 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one a canonicalized compound?

Yes, it is a canonicalized compound.

How many covalently-bonded units are there in 2,3,4,5-Tetrahydro-5-methyl-1H-pyrido[4,3-b]indol-1-one?

There is 1 covalently-bonded unit.

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