N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide

C17H18F6N2O — CID 46548552

IUPACN-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIInChI=1S/C17H18F6N2O/c18-16(19,20)11-7-10(8-12(9-11)17(21,22)23)15(26)24-13-3-5-25(6-4-13)14-1-2-14/h7-9,13-14H,1-6H2,(H,24,26)
InChIKeyNVFUHRORCYSVFE-UHFFFAOYSA-N
MW380.33 g/mol
LogP4.08
Rot. Bonds3

About N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide

N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide (PubChem CID 46548552) has the molecular formula C17H18F6N2O and a molecular weight of 380.33 g/mol. Its IUPAC name is N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide
PubChem CID46548552
Molecular FormulaC17H18F6N2O
Molecular Weight380.33 g/mol
Exact Mass380.13
IUPAC NameN-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide
SMILESO=C(NC1CCN(C2CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1
InChIInChI=1S/C17H18F6N2O/c18-16(19,20)11-7-10(8-12(9-11)17(21,22)23)15(26)24-13-3-5-25(6-4-13)14-1-2-14/h7-9,13-14H,1-6H2,(H,24,26)
InChIKeyNVFUHRORCYSVFE-UHFFFAOYSA-N
XLogP4.08
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.33
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide 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-(1-cyclopropylpiperidin-4-yl)-4-(trifluoromethylsulfonyl)benzamide
CID 55567282
N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-3,5-bis(trifluoromethyl)benzamide
CID 24609608
N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide
CID 60730497
3-bromo-N-(1-cyclopropylpiperidin-4-yl)benzamide
CID 60730541
N-(1-cyclopropylpiperidin-4-yl)-4-phenylbenzamide
CID 26131227
4-amino-N-(1-cyclopropylpiperidin-4-yl)-3-methylbenzamide
CID 43711761
N-cyclopentyl-3-ethynyl-5-(trifluoromethyl)benzamide
CID 162340861
N-cyclopropyl-2,6-bis(trifluoromethyl)pyridine-4-carboxamide
CID 30772760
3-iodo-N-piperidin-4-yl-5-(trifluoromethyl)benzamide;hydrochloride
CID 119388602
4-amino-3,5-dichloro-N-(1-cyclopropylpyrrolidin-3-yl)benzamide
CID 82833146
N-[2-(cyclobutylamino)-2-oxoethyl]-3,5-bis(trifluoromethyl)benzamide
CID 91363286
N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide
CID 110752030

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide?
The IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide (CID 46548552) is N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide.
What is the SMILES notation for N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide?
The canonical SMILES for N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide is O=C(NC1CCN(C2CC2)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1.
What is the InChIKey of N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide?
The InChIKey is NVFUHRORCYSVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F6N2O/c18-16(19,20)11-7-10(8-12(9-11)17(21,22)23)15(26)24-13-3-5-25(6-4-13)14-1-2-14/h7-9,13-14H,1-6H2,(H,24,26).
What are the key properties of N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide?
N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide has a molecular weight of 380.33 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpiperidin-4-yl)-3,5-bis(trifluoromethyl)benzamide is sourced from PubChem (CID 46548552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).