N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride

C18H24ClF3N2O2 — CID 166001185

IUPACN-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride
SMILESCl.O=C(NC1CCCC1)c1ccc(C2CCNCC2)cc1OC(F)(F)F
InChIInChI=1S/C18H23F3N2O2.ClH/c19-18(20,21)25-16-11-13(12-7-9-22-10-8-12)5-6-15(16)17(24)23-14-3-1-2-4-14;/h5-6,11-12,14,22H,1-4,7-10H2,(H,23,24);1H
InChIKeyIHLNNHDHVFOSCI-UHFFFAOYSA-N
MW392.85 g/mol
LogP4.15
Rot. Bonds4

About N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride

N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride (PubChem CID 166001185) has the molecular formula C18H24ClF3N2O2 and a molecular weight of 392.85 g/mol. Its IUPAC name is N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride.

Molecular Properties

Compound NameN-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride
PubChem CID166001185
Molecular FormulaC18H24ClF3N2O2
Molecular Weight392.85 g/mol
Exact Mass392.15
IUPAC NameN-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride
SMILESCl.O=C(NC1CCCC1)c1ccc(C2CCNCC2)cc1OC(F)(F)F
InChIInChI=1S/C18H23F3N2O2.ClH/c19-18(20,21)25-16-11-13(12-7-9-22-10-8-12)5-6-15(16)17(24)23-14-3-1-2-4-14;/h5-6,11-12,14,22H,1-4,7-10H2,(H,23,24);1H
InChIKeyIHLNNHDHVFOSCI-UHFFFAOYSA-N
XLogP4.15
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.85
LogP ≤ 54.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-piperidin-4-yl-N-propan-2-yl-2-(trifluoromethoxy)benzamide;hydrochloride
CID 166001167
[4-piperidin-4-yl-2-(trifluoromethoxy)phenyl]-pyrrolidin-1-ylmethanone;hydrochloride
CID 166001197
N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 171361893
N-cyclopentyl-3-piperidin-4-yl-5-(trifluoromethoxy)benzamide
CID 166176272
N-(2-methoxyethyl)-5-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride
CID 171393402
N-(cyclopropylmethyl)-5-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride
CID 171393398
[4-piperidin-4-yl-2-(trifluoromethoxy)phenyl]-[3-(trifluoromethyl)piperidin-1-yl]methanone;hydrochloride
CID 166001211
N-(2-methylpropyl)-5-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride
CID 171393396
N-cyclopropyl-3-piperidin-4-yl-5-(trifluoromethoxy)benzamide
CID 166176264
N-cycloheptyl-4-piperidin-4-ylpyridine-2-carboxamide
CID 122570407
2-fluoro-N-(oxan-4-yl)-5-piperidin-4-ylbenzamide
CID 171361952
N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride
CID 170456891

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride?
The IUPAC name of N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride (CID 166001185) is N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride.
What is the SMILES notation for N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride?
The canonical SMILES for N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride is Cl.O=C(NC1CCCC1)c1ccc(C2CCNCC2)cc1OC(F)(F)F.
What is the InChIKey of N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride?
The InChIKey is IHLNNHDHVFOSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23F3N2O2.ClH/c19-18(20,21)25-16-11-13(12-7-9-22-10-8-12)5-6-15(16)17(24)23-14-3-1-2-4-14;/h5-6,11-12,14,22H,1-4,7-10H2,(H,23,24);1H.
What are the key properties of N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride?
N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride has a molecular weight of 392.85 g/mol, XLogP of 4.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-piperidin-4-yl-2-(trifluoromethoxy)benzamide;hydrochloride is sourced from PubChem (CID 166001185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).