5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one

C14H22FN3O — CID 137449036

IUPAC5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one
SMILESCC(C)Nc1cc(F)cn(C2CCN(C)CC2)c1=O
InChIInChI=1S/C14H22FN3O/c1-10(2)16-13-8-11(15)9-18(14(13)19)12-4-6-17(3)7-5-12/h8-10,12,16H,4-7H2,1-3H3
InChIKeyLVYDPBRINZAICX-UHFFFAOYSA-N
MW267.35 g/mol
LogP2.07
Rot. Bonds3

About 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one

5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one (PubChem CID 137449036) has the molecular formula C14H22FN3O and a molecular weight of 267.35 g/mol. Its IUPAC name is 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one.

Molecular Properties

Compound Name5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one
PubChem CID137449036
Molecular FormulaC14H22FN3O
Molecular Weight267.35 g/mol
Exact Mass267.17
IUPAC Name5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one
SMILESCC(C)Nc1cc(F)cn(C2CCN(C)CC2)c1=O
InChIInChI=1S/C14H22FN3O/c1-10(2)16-13-8-11(15)9-18(14(13)19)12-4-6-17(3)7-5-12/h8-10,12,16H,4-7H2,1-3H3
InChIKeyLVYDPBRINZAICX-UHFFFAOYSA-N
XLogP2.07
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-acetamido-2-oxo-1-pyridinyl)-N-cyclohexylacetamide
CID 45268244
N-[1-(2-amino-2-oxoethyl)piperidin-3-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 72046541
N-(1-ethylpiperidin-3-yl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 72048283
6-methyl-N-(1-methylpiperidin-3-yl)-2-oxo-1H-pyridine-3-carboxamide
CID 72048293
1-Methyl-3-(piperidin-4-ylmethylamino)pyridin-2-one
CID 171346454
N-(1-acetylpiperidin-4-yl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 45807140
N-(1-ethyl-6-oxo-3-pyridinyl)-2-(4-methylpiperidin-1-yl)acetamide
CID 71849994
6-[(3S)-4-cyclopentyl-3-methylpiperazine-1-carbonyl]-1H-pyridin-2-one
CID 164640688
1-(Piperidin-4-yl)pyridin-2(1h)-one
CID 68690104
5-[2-(4,4-difluoropiperidin-1-yl)ethylamino]-1H-pyridin-2-one
CID 130377235
4-[(5-fluoro-2-oxo-1H-pyridin-3-yl)amino]piperidine-1-carboxylic acid
CID 132211447
tert-butyl 4-[(5-fluoro-2-oxo-1H-pyridin-3-yl)amino]piperidine-1-carboxylate
CID 132224869

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one?
The IUPAC name of 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one (CID 137449036) is 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one.
What is the SMILES notation for 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one?
The canonical SMILES for 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one is CC(C)Nc1cc(F)cn(C2CCN(C)CC2)c1=O.
What is the InChIKey of 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one?
The InChIKey is LVYDPBRINZAICX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22FN3O/c1-10(2)16-13-8-11(15)9-18(14(13)19)12-4-6-17(3)7-5-12/h8-10,12,16H,4-7H2,1-3H3.
What are the key properties of 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one?
5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one has a molecular weight of 267.35 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-(1-methylpiperidin-4-yl)-3-(propan-2-ylamino)pyridin-2-one is sourced from PubChem (CID 137449036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).