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Structure

2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]-

CAS
916254-29-0
Catalog Number
ACM916254290
Category
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What is the molecular formula of 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]-?

The molecular formula is C9H13N3O.

What is the molecular weight of 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]-?

The molecular weight is 179.22 g/mol.

What is the IUPAC name of 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]-?

The IUPAC name is 1-[(2-methyl-1H-imidazol-5-yl)methyl]pyrrolidin-2-one.

What is the InChI of 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]-?

The InChI is InChI=1S/C9H13N3O/c1-7-10-5-8(11-7)6-12-4-2-3-9(12)13/h5H,2-4,6H2,1H3,(H,10,11).

What is the InChIKey of 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]-?

The InChIKey is DLZVSRZPABRHMI-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]-?

The canonical SMILES is CC1=NC=C(N1)CN2CCCC2=O.

What is the XLogP3-AA value of 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]-?

The XLogP3-AA value is -0.1.

How many hydrogen bond donor counts does 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]- have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]- have?

It has 2 hydrogen bond acceptor counts.

How many rotatable bond counts does 2-Pyrrolidinone,1-[(2-methyl-1H-imidazol-5-yl)methyl]- have?

It has 2 rotatable bond counts.

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