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Structure

1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile

CAS
972-18-9
Catalog Number
ACM972189
Category
Heterocyclic Organic Compound
Molecular Weight
305.416720 [g/mol]
Molecular Formula
C20H23N3

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Specification

Synonyms
MLS002693817, NSC73009, MolPort-001-846-651, CID70416, EINECS 213-543-5, SMR001559758, 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile, 972-18-9
IUPAC Name
1-benzyl-4-(3-methylanilino)piperidine-4-carbonitrile
InChI Key
VRQNYTJDMMMAQU-UHFFFAOYSA-N
Boiling Point
484.4ºC at 760 mmHg
Flash Point
246.7ºC
Density
1.13g/cm³
Exact Mass
305.18900
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The molecular formula is C20H23N3.

What is the molecular weight of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The molecular weight is 305.4 g/mol.

What is the IUPAC name of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The IUPAC name is 1-benzyl-4-(3-methylanilino)piperidine-4-carbonitrile.

What is the InChI of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The InChI is InChI=1S/C20H23N3/c1-17-6-5-9-19(14-17)22-20(16-21)10-12-23(13-11-20)15-18-7-3-2-4-8-18/h2-9,14,22H,10-13,15H2,1H3.

What is the InChIKey of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The InChIKey is VRQNYTJDMMMAQU-UHFFFAOYSA-N.

What is the Canonical SMILES of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The Canonical SMILES is CC1=CC(=CC=C1)NC2(CCN(CC2)CC3=CC=CC=C3)C#N.

What is the CAS number of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The CAS number is 972-18-9.

What is the EC number of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The EC number is 213-543-5.

What is the ChEMBL ID of 1-Benzyl-4-(m-toluidino)piperidine-4-carbonitrile?

The ChEMBL ID is CHEMBL1896700.

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