2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide

C14H17F3N2O — CID 64817726

IUPAC2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C14H17F3N2O/c15-14(16,17)10-6-2-4-8-12(10)19-13(20)9-5-1-3-7-11(9)18/h2,4,6,8-9,11H,1,3,5,7,18H2,(H,19,20)
InChIKeyCXRHHHPCCZFOMT-UHFFFAOYSA-N
MW286.30 g/mol
LogP3.16
Rot. Bonds2

About 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide

2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide (PubChem CID 64817726) has the molecular formula C14H17F3N2O and a molecular weight of 286.30 g/mol. Its IUPAC name is 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide
PubChem CID64817726
Molecular FormulaC14H17F3N2O
Molecular Weight286.30 g/mol
Exact Mass286.13
IUPAC Name2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)Nc1ccccc1C(F)(F)F
InChIInChI=1S/C14H17F3N2O/c15-14(16,17)10-6-2-4-8-12(10)19-13(20)9-5-1-3-7-11(9)18/h2,4,6,8-9,11H,1,3,5,7,18H2,(H,19,20)
InChIKeyCXRHHHPCCZFOMT-UHFFFAOYSA-N
XLogP3.16
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2-hydroxyphenyl)cyclopentane-1-carboxamide
CID 64852235
2-amino-N-[2-(difluoromethylsulfanyl)phenyl]cyclohexane-1-carboxamide
CID 64817568
2-amino-N-(2-methylphenyl)cyclopentane-1-carboxamide
CID 64818336
2-amino-N-(2-iodophenyl)cyclopentane-1-carboxamide
CID 64824088
trans-(1R,2R)-2-amino-N-phenylcyclohexane-1-carboxamide
CID 10889384
methyl 2-[(2-aminocyclohexanecarbonyl)amino]benzoate
CID 64822923
2-[(2-tert-butylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 22688945
(1R,6R)-6-[[2-(trifluoromethyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 897574
3-[[2-(trifluoromethyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid
CID 103549795
2-amino-N-(3-bromo-2-hydroxyphenyl)cycloheptane-1-carboxamide
CID 81496913
(15S)-N-[2-(trifluoromethyl)phenyl]tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15-carboxamide
CID 1331323
2-amino-N-(2-ethylsulfanylphenyl)cyclohexane-1-carboxamide
CID 64823573

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide (CID 64817726) is 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide is NC1CCCCC1C(=O)Nc1ccccc1C(F)(F)F.
What is the InChIKey of 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide?
The InChIKey is CXRHHHPCCZFOMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O/c15-14(16,17)10-6-2-4-8-12(10)19-13(20)9-5-1-3-7-11(9)18/h2,4,6,8-9,11H,1,3,5,7,18H2,(H,19,20).
What are the key properties of 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide?
2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide has a molecular weight of 286.30 g/mol, XLogP of 3.16, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 64817726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).