3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide

C15H21N3O2 — CID 110269727

IUPAC3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide
SMILESCNC(=O)CCc1cccc(C2CCCN2C(C)=O)n1
InChIInChI=1S/C15H21N3O2/c1-11(19)18-10-4-7-14(18)13-6-3-5-12(17-13)8-9-15(20)16-2/h3,5-6,14H,4,7-10H2,1-2H3,(H,16,20)
InChIKeyDWGUYJXKCNEZOU-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.44
Rot. Bonds4

About 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide

3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide (PubChem CID 110269727) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide.

Molecular Properties

Compound Name3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide
PubChem CID110269727
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide
SMILESCNC(=O)CCc1cccc(C2CCCN2C(C)=O)n1
InChIInChI=1S/C15H21N3O2/c1-11(19)18-10-4-7-14(18)13-6-3-5-12(17-13)8-9-15(20)16-2/h3,5-6,14H,4,7-10H2,1-2H3,(H,16,20)
InChIKeyDWGUYJXKCNEZOU-UHFFFAOYSA-N
XLogP1.44
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-[6-(1-propan-2-ylpyrrolidin-2-yl)-2-pyridinyl]propanamide
CID 110269724
6-[(2S)-1-acetylpyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
CID 95816016
6-[(2R)-1-acetylpyrrolidin-2-yl]-N-methylpyridine-2-carboxamide
CID 95816015
1-[2-(6-methyl-2-pyridinyl)pyrrolidin-1-yl]ethanone
CID 102538999
3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide
CID 95820731
N-(2-hydroxyethyl)-3-[6-[(2R)-1-methylpyrrolidin-2-yl]-2-pyridinyl]propanamide
CID 95842714
3-[6-[1-(pyrazine-2-carbonyl)pyrrolidin-2-yl]-2-pyridinyl]propanoic acid
CID 110258258
1-[4-[2-[6-[(2-chlorophenyl)methyl]-2-pyridinyl]pyrrolidine-1-carbonyl]piperidin-1-yl]ethanone
CID 110254684
3-[6-[1-(4-hydroxyoxolan-3-yl)piperidin-4-yl]-2-pyridinyl]-N-methylpropanamide
CID 110097360
N-[[6-[(2R)-1-(3-thiophen-2-ylpropanoyl)pyrrolidin-2-yl]-2-pyridinyl]methyl]acetamide
CID 124963053
1-[2-(6-benzyl-2-pyridinyl)pyrrolidin-1-yl]-2-methoxyethanone
CID 110254541
3-[6-[(2S)-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-yl]-2-pyridinyl]propanoic acid
CID 124973545

Frequently Asked Questions

What is the IUPAC name of 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide?
The IUPAC name of 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide (CID 110269727) is 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide.
What is the SMILES notation for 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide?
The canonical SMILES for 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide is CNC(=O)CCc1cccc(C2CCCN2C(C)=O)n1.
What is the InChIKey of 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide?
The InChIKey is DWGUYJXKCNEZOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-11(19)18-10-4-7-14(18)13-6-3-5-12(17-13)8-9-15(20)16-2/h3,5-6,14H,4,7-10H2,1-2H3,(H,16,20).
What are the key properties of 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide?
3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide has a molecular weight of 275.35 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide is sourced from PubChem (CID 110269727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).