1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one

C12H14N2O — CID 22733091

IUPAC1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one
SMILESC=C(CN1CCCC1=O)c1cccnc1
InChIInChI=1S/C12H14N2O/c1-10(11-4-2-6-13-8-11)9-14-7-3-5-12(14)15/h2,4,6,8H,1,3,5,7,9H2
InChIKeyCINDXFGZQSBBPU-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.72
Rot. Bonds3

About 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one

1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one (PubChem CID 22733091) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one
PubChem CID22733091
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one
SMILESC=C(CN1CCCC1=O)c1cccnc1
InChIInChI=1S/C12H14N2O/c1-10(11-4-2-6-13-8-11)9-14-7-3-5-12(14)15/h2,4,6,8H,1,3,5,7,9H2
InChIKeyCINDXFGZQSBBPU-UHFFFAOYSA-N
XLogP1.72
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(pyridine-3-carbonyl)piperidin-2-one
CID 18935202
1-(2-pyridin-3-ylethyl)pyrrolidin-2-one
CID 59074969
N-[(1S)-2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]pyridine-3-carboxamide
CID 94198526
1-[(3Z)-3-prop-2-ynoxyimino-3-pyridin-3-ylpropyl]pyrrolidin-2-one
CID 10125368
N'-[2-(3,4-dihydro-2H-quinolin-1-yl)acetyl]pyridine-3-carbohydrazide
CID 51109543
1-[(2E)-2-prop-2-ynoxyimino-3-pyridin-3-ylpropyl]pyrrolidin-2-one
CID 10171561
1-[2-(phenylmethoxyamino)-3-pyridin-3-ylprop-2-enyl]pyrrolidin-2-one
CID 90729389
N-[2-[di(propan-2-yl)amino]ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide;3-phenoxypyridine;sulfuric acid
CID 67898460
N-(3-acetylphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 9209614
S-(2-oxoazetidin-1-yl) pyridine-3-carbothioate
CID 158660231
1-[2-[2-phenylethyl(pyridin-3-ylmethyl)amino]ethyl]pyrrolidin-2-one
CID 134700180
CID 157283677
CID 157283677

Frequently Asked Questions

What is the IUPAC name of 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one (CID 22733091) is 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one is C=C(CN1CCCC1=O)c1cccnc1.
What is the InChIKey of 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one?
The InChIKey is CINDXFGZQSBBPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-10(11-4-2-6-13-8-11)9-14-7-3-5-12(14)15/h2,4,6,8H,1,3,5,7,9H2.
What are the key properties of 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one?
1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one has a molecular weight of 202.26 g/mol, XLogP of 1.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyridin-3-ylprop-2-enyl)pyrrolidin-2-one is sourced from PubChem (CID 22733091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).