2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one

C17H25FN2O — CID 114829382

IUPAC2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one
SMILESCC(Cc1ccccc1F)NC(C)C(=O)N1CCCCC1
InChIInChI=1S/C17H25FN2O/c1-13(12-15-8-4-5-9-16(15)18)19-14(2)17(21)20-10-6-3-7-11-20/h4-5,8-9,13-14,19H,3,6-7,10-12H2,1-2H3
InChIKeyOVOUNXVSLOWKHV-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.75
Rot. Bonds5

About 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one

2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one (PubChem CID 114829382) has the molecular formula C17H25FN2O and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one.

Molecular Properties

Compound Name2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one
PubChem CID114829382
Molecular FormulaC17H25FN2O
Molecular Weight292.40 g/mol
Exact Mass292.20
IUPAC Name2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one
SMILESCC(Cc1ccccc1F)NC(C)C(=O)N1CCCCC1
InChIInChI=1S/C17H25FN2O/c1-13(12-15-8-4-5-9-16(15)18)19-14(2)17(21)20-10-6-3-7-11-20/h4-5,8-9,13-14,19H,3,6-7,10-12H2,1-2H3
InChIKeyOVOUNXVSLOWKHV-UHFFFAOYSA-N
XLogP2.75
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-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

1-[(2R)-1-(2-fluorophenyl)propan-2-yl]-3-[(2S)-1-oxo-1-piperidin-1-ylpropan-2-yl]urea
CID 95284220
1-(azepan-1-yl)-2-(2-fluoroanilino)propan-1-one
CID 43086908
3-(2-fluorophenyl)-2-methyl-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]propanamide
CID 110306138
2-[(2,3-difluorophenyl)methylamino]-1-pyrrolidin-1-ylpropan-1-one
CID 115618240
[4-[[1-(2-fluorophenyl)propan-2-ylamino]methyl]phenyl]-pyrrolidin-1-ylmethanone
CID 50973621
[4-[[[(2R)-1-(2-fluorophenyl)propan-2-yl]amino]methyl]phenyl]-pyrrolidin-1-ylmethanone
CID 95135521
2-fluoro-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)benzamide
CID 61041045
3-(2-fluorophenyl)-2-methyl-1-[4-(3-pyrrolidin-1-ylpropanoyl)piperazin-1-yl]propan-1-one
CID 110617982
3-(2-fluorophenyl)-2-methyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one
CID 119493132
2-[(2-ethylphenyl)methylamino]-1-piperidin-1-ylpropan-1-one
CID 62392311
methyl 4-[3-(2-fluorophenyl)-2-methylpropanoyl]piperazine-1-carboxylate
CID 110352236
1-(1,4-diazepan-1-yl)-3-(2-fluorophenyl)-2-methylpropan-1-one;hydrochloride
CID 119418204

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one?
The IUPAC name of 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one (CID 114829382) is 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one.
What is the SMILES notation for 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one?
The canonical SMILES for 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one is CC(Cc1ccccc1F)NC(C)C(=O)N1CCCCC1.
What is the InChIKey of 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one?
The InChIKey is OVOUNXVSLOWKHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O/c1-13(12-15-8-4-5-9-16(15)18)19-14(2)17(21)20-10-6-3-7-11-20/h4-5,8-9,13-14,19H,3,6-7,10-12H2,1-2H3.
What are the key properties of 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one?
2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one has a molecular weight of 292.40 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-fluorophenyl)propan-2-ylamino]-1-piperidin-1-ylpropan-1-one is sourced from PubChem (CID 114829382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).