2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide

C14H23F3N2O — CID 106739127

IUPAC2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide
SMILESCC1CC(C(=O)NC2CCC(C(F)(F)F)CC2)CCN1
InChIInChI=1S/C14H23F3N2O/c1-9-8-10(6-7-18-9)13(20)19-12-4-2-11(3-5-12)14(15,16)17/h9-12,18H,2-8H2,1H3,(H,19,20)
InChIKeySZTMOMAJBKGFEM-UHFFFAOYSA-N
MW292.35 g/mol
LogP2.61
Rot. Bonds2

About 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide

2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide (PubChem CID 106739127) has the molecular formula C14H23F3N2O and a molecular weight of 292.35 g/mol. Its IUPAC name is 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide
PubChem CID106739127
Molecular FormulaC14H23F3N2O
Molecular Weight292.35 g/mol
Exact Mass292.18
IUPAC Name2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide
SMILESCC1CC(C(=O)NC2CCC(C(F)(F)F)CC2)CCN1
InChIInChI=1S/C14H23F3N2O/c1-9-8-10(6-7-18-9)13(20)19-12-4-2-11(3-5-12)14(15,16)17/h9-12,18H,2-8H2,1H3,(H,19,20)
InChIKeySZTMOMAJBKGFEM-UHFFFAOYSA-N
XLogP2.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4S)-2-methyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]piperidine-4-carboxamide
CID 120618489
N-cyclohexyl-2-methylpiperidine-4-carboxamide
CID 106738484
N-(2-methylpiperidin-4-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 106995136
N-(4-carbamoylcyclohexyl)-2-methylpiperidine-4-carboxamide
CID 106738893
(2S,4S)-2-methyl-N-(3-methylcyclobutyl)piperidine-4-carboxamide
CID 120633929
2-methyl-N-[4-(trifluoromethyl)cyclohexyl]pyrrolidine-3-carboxamide
CID 79388833
(2S,4S)-2-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide;hydrochloride
CID 120637437
N-cyclopropyl-3-(trifluoromethyl)cyclopentane-1-carboxamide
CID 126783084
N-(1-cyclopropylpiperidin-4-yl)-2-methylpiperidine-4-carboxamide
CID 106739107
4-tert-butyl-N-(2-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 106995414
(2S,4S)-N-(3-carbamoylcyclohexyl)-2-methylpiperidine-4-carboxamide
CID 120628042
(2S,4S)-N-[1-(cyclopropylmethyl)piperidin-4-yl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120633533

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide?
The IUPAC name of 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide (CID 106739127) is 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide.
What is the SMILES notation for 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide?
The canonical SMILES for 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide is CC1CC(C(=O)NC2CCC(C(F)(F)F)CC2)CCN1.
What is the InChIKey of 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide?
The InChIKey is SZTMOMAJBKGFEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N2O/c1-9-8-10(6-7-18-9)13(20)19-12-4-2-11(3-5-12)14(15,16)17/h9-12,18H,2-8H2,1H3,(H,19,20).
What are the key properties of 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide?
2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide has a molecular weight of 292.35 g/mol, XLogP of 2.61, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(trifluoromethyl)cyclohexyl]piperidine-4-carboxamide is sourced from PubChem (CID 106739127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).