4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide

C15H18F3NO — CID 8900200

IUPAC4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide
SMILESO=C(NCC(F)(F)F)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C15H18F3NO/c16-15(17,18)10-19-14(20)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-9,11H,1-5,10H2,(H,19,20)
InChIKeyKPYXGRLEWLQTMR-UHFFFAOYSA-N
MW285.31 g/mol
LogP4.03
Rot. Bonds3

About 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide

4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide (PubChem CID 8900200) has the molecular formula C15H18F3NO and a molecular weight of 285.31 g/mol. Its IUPAC name is 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide.

Molecular Properties

Compound Name4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide
PubChem CID8900200
Molecular FormulaC15H18F3NO
Molecular Weight285.31 g/mol
Exact Mass285.13
IUPAC Name4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide
SMILESO=C(NCC(F)(F)F)c1ccc(C2CCCCC2)cc1
InChIInChI=1S/C15H18F3NO/c16-15(17,18)10-19-14(20)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-9,11H,1-5,10H2,(H,19,20)
InChIKeyKPYXGRLEWLQTMR-UHFFFAOYSA-N
XLogP4.03
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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ethyl 2-[(4-cyclohexylbenzoyl)amino]acetate
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methyl 2-[(4-cyclopentylbenzoyl)amino]acetate
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4-cyclohexyl-N'-methylbenzohydrazide
CID 116846851
4-(3-cyclohexylpropanoylamino)-N-(2,2,2-trifluoroethyl)benzamide
CID 46803503
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CID 3753475
4-cyclohexyl-N-[2-(ethylamino)ethyl]benzamide
CID 119504655
N-(3-amino-2-methylpropyl)-4-cyclohexylbenzamide
CID 119995934
4-cyclohexyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 18162781
1-(4-cyclohexylphenyl)-2-(2,2,2-trifluoroethoxy)ethanone
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CID 71850129

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide?
The IUPAC name of 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide (CID 8900200) is 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide.
What is the SMILES notation for 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide?
The canonical SMILES for 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide is O=C(NCC(F)(F)F)c1ccc(C2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide?
The InChIKey is KPYXGRLEWLQTMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18F3NO/c16-15(17,18)10-19-14(20)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-9,11H,1-5,10H2,(H,19,20).
What are the key properties of 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide?
4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide has a molecular weight of 285.31 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide is sourced from PubChem (CID 8900200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).