2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride

C14H18ClF3N2O — CID 119706448

IUPAC2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCc1ccc(C(F)(F)F)cc1NC(=O)C1CCCC1N.Cl
InChIInChI=1S/C14H17F3N2O.ClH/c1-8-5-6-9(14(15,16)17)7-12(8)19-13(20)10-3-2-4-11(10)18;/h5-7,10-11H,2-4,18H2,1H3,(H,19,20);1H
InChIKeyOBXOYDYTCNJPCF-UHFFFAOYSA-N
MW322.76 g/mol
LogP3.50
Rot. Bonds2

About 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride

2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119706448) has the molecular formula C14H18ClF3N2O and a molecular weight of 322.76 g/mol. Its IUPAC name is 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119706448
Molecular FormulaC14H18ClF3N2O
Molecular Weight322.76 g/mol
Exact Mass322.11
IUPAC Name2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCc1ccc(C(F)(F)F)cc1NC(=O)C1CCCC1N.Cl
InChIInChI=1S/C14H17F3N2O.ClH/c1-8-5-6-9(14(15,16)17)7-12(8)19-13(20)10-3-2-4-11(10)18;/h5-7,10-11H,2-4,18H2,1H3,(H,19,20);1H
InChIKeyOBXOYDYTCNJPCF-UHFFFAOYSA-N
XLogP3.50
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.76
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 64824704
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2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119679603
(2S)-N-[2-methyl-5-(trifluoromethyl)phenyl]pyrrolidine-2-carboxamide
CID 66478130
2-amino-N-(2,4-dimethylphenyl)cyclopentane-1-carboxamide
CID 64816599
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CID 110015166
2,2-dimethyl-N-[2-methyl-5-(trifluoromethyl)phenyl]propanamide
CID 66475481
N-[(2-hydroxycyclopentyl)methyl]-N'-[2-methyl-5-(trifluoromethyl)phenyl]oxamide
CID 111566950
2-amino-N-[2-(trifluoromethyl)phenyl]cyclohexane-1-carboxamide
CID 64817726
N-(5-fluoro-2-methylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110013638
2-amino-N-(3-bromo-4-methylphenyl)cyclopentane-1-carboxamide
CID 64825039
2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120785843

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride (CID 119706448) is 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride is Cc1ccc(C(F)(F)F)cc1NC(=O)C1CCCC1N.Cl.
What is the InChIKey of 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is OBXOYDYTCNJPCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O.ClH/c1-8-5-6-9(14(15,16)17)7-12(8)19-13(20)10-3-2-4-11(10)18;/h5-7,10-11H,2-4,18H2,1H3,(H,19,20);1H.
What are the key properties of 2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 322.76 g/mol, XLogP of 3.50, 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-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119706448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).