1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one

C15H21F3N2O — CID 64757272

IUPAC1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one
SMILESCCCn1cc(NC2CCCCC2C(F)(F)F)ccc1=O
InChIInChI=1S/C15H21F3N2O/c1-2-9-20-10-11(7-8-14(20)21)19-13-6-4-3-5-12(13)15(16,17)18/h7-8,10,12-13,19H,2-6,9H2,1H3
InChIKeyHSYPAOPCNLHIPE-UHFFFAOYSA-N
MW302.34 g/mol
LogP3.79
Rot. Bonds4

About 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one

1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one (PubChem CID 64757272) has the molecular formula C15H21F3N2O and a molecular weight of 302.34 g/mol. Its IUPAC name is 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one.

Molecular Properties

Compound Name1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one
PubChem CID64757272
Molecular FormulaC15H21F3N2O
Molecular Weight302.34 g/mol
Exact Mass302.16
IUPAC Name1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one
SMILESCCCn1cc(NC2CCCCC2C(F)(F)F)ccc1=O
InChIInChI=1S/C15H21F3N2O/c1-2-9-20-10-11(7-8-14(20)21)19-13-6-4-3-5-12(13)15(16,17)18/h7-8,10,12-13,19H,2-6,9H2,1H3
InChIKeyHSYPAOPCNLHIPE-UHFFFAOYSA-N
XLogP3.79
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]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

5-Amino-1-(4,4-difluorocyclohexyl)-3-methylpyridin-2-one
CID 171484569
4-[2-(cyclohexylmethyl)-5-methyl-4-(trifluoromethyl)-3H-pyrazol-1-yl]-1H-pyridin-2-one
CID 175828635
N-[(1R,2R)-2-methylcyclohexyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 7633469
N-[(1R,2S)-2-methylcyclohexyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 7633470
N-[(1S,2R)-2-methylcyclohexyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 7633473
N-[(1S,2S)-2-methylcyclohexyl]-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 7633475
2-oxo-N-[3-(trifluoromethyl)cyclohexyl]-1H-pyridine-3-carboxamide
CID 18147826
N-(2-methylcyclohexyl)-2-[2-oxo-5-(trifluoromethyl)-1-pyridinyl]acetamide
CID 18777169
N-(2-methylcyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 24243490
N-(4-methylcyclohexyl)-2-oxo-6-(trifluoromethyl)-1H-pyridine-3-carboxamide
CID 24608409
N-[(1S,2R)-2-methylcyclohexyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 32370570
N-[(1S,2S)-2-methylcyclohexyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 32370584

Frequently Asked Questions

What is the IUPAC name of 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one?
The IUPAC name of 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one (CID 64757272) is 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one.
What is the SMILES notation for 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one?
The canonical SMILES for 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one is CCCn1cc(NC2CCCCC2C(F)(F)F)ccc1=O.
What is the InChIKey of 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one?
The InChIKey is HSYPAOPCNLHIPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F3N2O/c1-2-9-20-10-11(7-8-14(20)21)19-13-6-4-3-5-12(13)15(16,17)18/h7-8,10,12-13,19H,2-6,9H2,1H3.
What are the key properties of 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one?
1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one has a molecular weight of 302.34 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-5-[[2-(trifluoromethyl)cyclohexyl]amino]pyridin-2-one is sourced from PubChem (CID 64757272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).