N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide

C15H23F5N2O — CID 176759241

IUPACN-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide
SMILESCN(CC1CCC(F)(F)CC1)C(=O)C1(C(F)(F)F)CCNCC1
InChIInChI=1S/C15H23F5N2O/c1-22(10-11-2-4-14(16,17)5-3-11)12(23)13(15(18,19)20)6-8-21-9-7-13/h11,21H,2-10H2,1H3
InChIKeyQILWHVQMNGRBLM-UHFFFAOYSA-N
MW342.35 g/mol
LogP3.20
Rot. Bonds3

About N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide

N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide (PubChem CID 176759241) has the molecular formula C15H23F5N2O and a molecular weight of 342.35 g/mol. Its IUPAC name is N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide
PubChem CID176759241
Molecular FormulaC15H23F5N2O
Molecular Weight342.35 g/mol
Exact Mass342.17
IUPAC NameN-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide
SMILESCN(CC1CCC(F)(F)CC1)C(=O)C1(C(F)(F)F)CCNCC1
InChIInChI=1S/C15H23F5N2O/c1-22(10-11-2-4-14(16,17)5-3-11)12(23)13(15(18,19)20)6-8-21-9-7-13/h11,21H,2-10H2,1H3
InChIKeyQILWHVQMNGRBLM-UHFFFAOYSA-N
XLogP3.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-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-(cyclohexylmethyl)-N-methyl-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 63709696
N-[(4,4-difluorocyclohexyl)methyl]-4-(trifluoromethyl)piperidine-4-carboxamide
CID 176759497
N-methyl-N-(oxan-3-ylmethyl)-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 63719753
N-(cyclopentylmethyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 63657339
N-(2-hydroxy-2-methylpropyl)-N-methyl-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 79380351
N-(cyclobutylmethyl)-4-methoxy-N-methylpiperidine-4-carboxamide
CID 119770688
N-(cyclohexylmethyl)-N-methyl-4-propylpiperidine-4-carboxamide
CID 63128373
N-(cyclopentylmethyl)-4-methoxy-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119759240
N-(cyclohexylmethyl)-4-methoxy-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119704445
N-cyclopentyl-N-methyl-3-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 55227271
N-(cyclobutylmethyl)-3-ethyl-N-methylpyrrolidine-3-carboxamide
CID 63142224
2-[ethyl-[3-(trifluoromethyl)pyrrolidine-3-carbonyl]amino]-2-methylpropanoic acid
CID 63720094

Frequently Asked Questions

What is the IUPAC name of N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide?
The IUPAC name of N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide (CID 176759241) is N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide?
The canonical SMILES for N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide is CN(CC1CCC(F)(F)CC1)C(=O)C1(C(F)(F)F)CCNCC1.
What is the InChIKey of N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide?
The InChIKey is QILWHVQMNGRBLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23F5N2O/c1-22(10-11-2-4-14(16,17)5-3-11)12(23)13(15(18,19)20)6-8-21-9-7-13/h11,21H,2-10H2,1H3.
What are the key properties of N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide?
N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide has a molecular weight of 342.35 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,4-difluorocyclohexyl)methyl]-N-methyl-4-(trifluoromethyl)piperidine-4-carboxamide is sourced from PubChem (CID 176759241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).