2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide

C13H19N3O — CID 110851953

IUPAC2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide
SMILESCN1CCCC1CC(=O)NCc1ccccn1
InChIInChI=1S/C13H19N3O/c1-16-8-4-6-12(16)9-13(17)15-10-11-5-2-3-7-14-11/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,15,17)
InChIKeyYXQJYBZNSJDYGW-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.18
Rot. Bonds4

About 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide

2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 110851953) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide
PubChem CID110851953
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide
SMILESCN1CCCC1CC(=O)NCc1ccccn1
InChIInChI=1S/C13H19N3O/c1-16-8-4-6-12(16)9-13(17)15-10-11-5-2-3-7-14-11/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,15,17)
InChIKeyYXQJYBZNSJDYGW-UHFFFAOYSA-N
XLogP1.18
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2R)-1-(benzenesulfonyl)piperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 42065143
2-[(2R)-1-(4-methylphenyl)sulfonylpiperidin-2-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 26562145
2-[(2R)-2-(phenoxymethyl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 96538815
2-(3-methylpiperidin-1-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 108999232
2-[(2S)-2-(3-hydroxypropyl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95626153
2-[(2S)-2-[(4-methylphenyl)methyl]pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95626006
2-ethyl-4-methyl-N-[[(2S,5R)-1-methyl-5-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]pyrrolidin-2-yl]methyl]-1,3-oxazole-5-carboxamide
CID 171389370
ethyl 2-[1-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]piperidin-2-yl]acetate
CID 56883612
1-methyl-5-oxo-N-(pyridin-2-ylmethyl)pyrrolidine-2-carboxamide
CID 110687259
2-[(2R)-2-[(4-methylpyrazol-1-yl)methyl]pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 95354502
2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 56803059
2-(1-methylpiperazin-2-yl)-N-(2-pyridin-2-ylethyl)acetamide
CID 115178439

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide (CID 110851953) is 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide is CN1CCCC1CC(=O)NCc1ccccn1.
What is the InChIKey of 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is YXQJYBZNSJDYGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-16-8-4-6-12(16)9-13(17)15-10-11-5-2-3-7-14-11/h2-3,5,7,12H,4,6,8-10H2,1H3,(H,15,17).
What are the key properties of 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide?
2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 233.31 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylpyrrolidin-2-yl)-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 110851953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).