(3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide

C18H23F3N2O2S — CID 30787670

IUPAC(3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide
SMILESO=C(NC1CCC(C(F)(F)F)CC1)[C@@H]1CCCN(C(=O)c2cccs2)C1
InChIInChI=1S/C18H23F3N2O2S/c19-18(20,21)13-5-7-14(8-6-13)22-16(24)12-3-1-9-23(11-12)17(25)15-4-2-10-26-15/h2,4,10,12-14H,1,3,5-9,11H2,(H,22,24)/t12-,13?,14?/m1/s1
InChIKeyQHTKYGMCBGIATH-IYXRBSQSSA-N
MW388.46 g/mol
LogP3.84
Rot. Bonds3

About (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide

(3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide (PubChem CID 30787670) has the molecular formula C18H23F3N2O2S and a molecular weight of 388.46 g/mol. Its IUPAC name is (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide
PubChem CID30787670
Molecular FormulaC18H23F3N2O2S
Molecular Weight388.46 g/mol
Exact Mass388.14
IUPAC Name(3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide
SMILESO=C(NC1CCC(C(F)(F)F)CC1)[C@@H]1CCCN(C(=O)c2cccs2)C1
InChIInChI=1S/C18H23F3N2O2S/c19-18(20,21)13-5-7-14(8-6-13)22-16(24)12-3-1-9-23(11-12)17(25)15-4-2-10-26-15/h2,4,10,12-14H,1,3,5-9,11H2,(H,22,24)/t12-,13?,14?/m1/s1
InChIKeyQHTKYGMCBGIATH-IYXRBSQSSA-N
XLogP3.84
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.46
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide 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

N-cyclododecyl-1-(thiophene-2-carbonyl)azetidine-3-carboxamide
CID 90511039
(3S)-1-(thiophene-2-carbonyl)-N'-[2-(trifluoromethyl)phenyl]piperidine-3-carbohydrazide
CID 39982573
(3S)-N-[(1S,2R)-2-methylcyclohexyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 124743109
(3S)-N-[(1R,2R)-2-methylcyclohexyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 124743110
N-[1-(4-cyanophenyl)piperidin-4-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 86868702
N-cyclopropyl-1-[1-methyl-5-(thiophene-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]piperidine-3-carboxamide
CID 53018181
(3R)-1-(thiophene-2-carbonyl)piperidine-3-carboxylic acid
CID 858666
N-(3-cyclopentylpropyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 43057667
N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 43057486
N-[1-(thiophene-2-carbonyl)piperidin-4-yl]cyclopropanecarboxamide
CID 46446282
[(3S)-3-(methylamino)piperidin-1-yl]-thiophen-2-ylmethanone
CID 94475795
N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 86934095

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide?
The IUPAC name of (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide (CID 30787670) is (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide is O=C(NC1CCC(C(F)(F)F)CC1)[C@@H]1CCCN(C(=O)c2cccs2)C1.
What is the InChIKey of (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide?
The InChIKey is QHTKYGMCBGIATH-IYXRBSQSSA-N. The full InChI is InChI=1S/C18H23F3N2O2S/c19-18(20,21)13-5-7-14(8-6-13)22-16(24)12-3-1-9-23(11-12)17(25)15-4-2-10-26-15/h2,4,10,12-14H,1,3,5-9,11H2,(H,22,24)/t12-,13?,14?/m1/s1.
What are the key properties of (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide?
(3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide has a molecular weight of 388.46 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(thiophene-2-carbonyl)-N-[4-(trifluoromethyl)cyclohexyl]piperidine-3-carboxamide is sourced from PubChem (CID 30787670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).