1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one

C16H22N2O3 — CID 138380813

IUPAC1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one
SMILESCCn1ccc(C(=O)N2CCC(C3(O)CC3)CC2)cc1=O
InChIInChI=1S/C16H22N2O3/c1-2-17-8-3-12(11-14(17)19)15(20)18-9-4-13(5-10-18)16(21)6-7-16/h3,8,11,13,21H,2,4-7,9-10H2,1H3
InChIKeySQAAWTYCAWEFLR-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.25
Rot. Bonds3

About 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one

1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one (PubChem CID 138380813) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one.

Molecular Properties

Compound Name1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one
PubChem CID138380813
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one
SMILESCCn1ccc(C(=O)N2CCC(C3(O)CC3)CC2)cc1=O
InChIInChI=1S/C16H22N2O3/c1-2-17-8-3-12(11-14(17)19)15(20)18-9-4-13(5-10-18)16(21)6-7-16/h3,8,11,13,21H,2,4-7,9-10H2,1H3
InChIKeySQAAWTYCAWEFLR-UHFFFAOYSA-N
XLogP1.25
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(azocane-1-carbonyl)-1-ethylpyridin-2-one
CID 74249419
4-[(3S)-3-[(dimethylamino)methyl]-3-hydroxypyrrolidine-1-carbonyl]-1-ethylpyridin-2-one
CID 95720033
1-ethyl-4-[(1R,3S)-1-hydroxy-3-methoxy-3-methyl-7-azaspiro[3.5]nonane-7-carbonyl]pyridin-2-one
CID 72859044
1-ethyl-4-(1-ethyl-3-azabicyclo[3.1.0]hexane-3-carbonyl)pyridin-2-one
CID 138387519
4-[3-(4-aminopiperidin-1-yl)pyrrolidine-1-carbonyl]-1-ethylpyridin-2-one
CID 167804541
1-ethyl-4-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)pyridin-2-one
CID 77085377
1-ethyl-4-(3-methyl-3-phenylpiperidine-1-carbonyl)pyridin-2-one
CID 72931976
7-(cyclopropylmethyl)-2-(1-ethyl-2-oxopyridine-4-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72902847
1-ethyl-4-[(3R)-3-[[3-(hydroxymethyl)phenyl]methyl]pyrrolidine-1-carbonyl]pyridin-2-one
CID 97136366
4-[(3S,4R)-3-(dimethylamino)-4-propan-2-ylpyrrolidine-1-carbonyl]-1-ethylpyridin-2-one
CID 72902347
1-ethyl-4-[(4R)-4-hydroxy-3,4-dihydro-1H-isoquinoline-2-carbonyl]pyridin-2-one
CID 96575454
[4-(1-hydroxycyclopropyl)piperidin-1-yl]-(2-methylphenyl)methanone
CID 138382236

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one?
The IUPAC name of 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one (CID 138380813) is 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one.
What is the SMILES notation for 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one?
The canonical SMILES for 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one is CCn1ccc(C(=O)N2CCC(C3(O)CC3)CC2)cc1=O.
What is the InChIKey of 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one?
The InChIKey is SQAAWTYCAWEFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-2-17-8-3-12(11-14(17)19)15(20)18-9-4-13(5-10-18)16(21)6-7-16/h3,8,11,13,21H,2,4-7,9-10H2,1H3.
What are the key properties of 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one?
1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one has a molecular weight of 290.36 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[4-(1-hydroxycyclopropyl)piperidine-1-carbonyl]pyridin-2-one is sourced from PubChem (CID 138380813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).