3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one

C10H12F2N2O — CID 170791716

IUPAC3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one
SMILESO=c1[nH]cccc1N1CCC(F)(F)CC1
InChIInChI=1S/C10H12F2N2O/c11-10(12)3-6-14(7-4-10)8-2-1-5-13-9(8)15/h1-2,5H,3-4,6-7H2,(H,13,15)
InChIKeyOVVNAJIPUIWPRC-UHFFFAOYSA-N
MW214.22 g/mol
LogP1.61
Rot. Bonds1

About 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one

3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one (PubChem CID 170791716) has the molecular formula C10H12F2N2O and a molecular weight of 214.22 g/mol. Its IUPAC name is 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one
PubChem CID170791716
Molecular FormulaC10H12F2N2O
Molecular Weight214.22 g/mol
Exact Mass214.09
IUPAC Name3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one
SMILESO=c1[nH]cccc1N1CCC(F)(F)CC1
InChIInChI=1S/C10H12F2N2O/c11-10(12)3-6-14(7-4-10)8-2-1-5-13-9(8)15/h1-2,5H,3-4,6-7H2,(H,13,15)
InChIKeyOVVNAJIPUIWPRC-UHFFFAOYSA-N
XLogP1.61
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-acetylpiperidin-4-yl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 45807140
3-Amino-1-(4,4,4-trifluorobutyl)-1,2-dihydropyridin-2-one
CID 115513885
4-(4,4-difluoropiperidin-1-yl)-3-nitroso-1H-pyridin-2-one
CID 129211618
5-[2-(4,4-difluoropiperidin-1-yl)ethylamino]-1H-pyridin-2-one
CID 130377235
5-Fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one
CID 137449036
1-[(3S)-1-(2-fluoroethyl)piperidin-3-yl]-3-(methylamino)pyridin-2-one
CID 137449077
1-[(3R)-1-(2-fluoroethyl)piperidin-3-yl]-3-(methylamino)pyridin-2-one
CID 137449078
1-[1-(2,2-Difluoroethyl)piperidin-4-yl]-3-(propan-2-ylamino)pyridin-2-one
CID 137449097
1-[1-(2-Fluoroethyl)piperidin-4-yl]-3-(methylamino)pyridin-2-one
CID 137449100
1-[1-(2-Fluoroethyl)piperidin-3-yl]-3-(methylamino)pyridin-2-one
CID 137449107
1-(3,3-Difluorocyclobutyl)-3-(methylamino)pyridin-2-one
CID 137449445
1-[(4S)-3,3-difluoro-1-methylpiperidin-4-yl]-3-(methylamino)pyridin-2-one
CID 137449496

Frequently Asked Questions

What is the IUPAC name of 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one?
The IUPAC name of 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one (CID 170791716) is 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one.
What is the SMILES notation for 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one?
The canonical SMILES for 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one is O=c1[nH]cccc1N1CCC(F)(F)CC1.
What is the InChIKey of 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one?
The InChIKey is OVVNAJIPUIWPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O/c11-10(12)3-6-14(7-4-10)8-2-1-5-13-9(8)15/h1-2,5H,3-4,6-7H2,(H,13,15).
What are the key properties of 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one?
3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one has a molecular weight of 214.22 g/mol, XLogP of 1.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,4-difluoropiperidin-1-yl)-1H-pyridin-2-one is sourced from PubChem (CID 170791716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).