2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride

C13H18ClFN2O — CID 119679603

IUPAC2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCc1cc(F)ccc1NC(=O)C1CCCC1N.Cl
InChIInChI=1S/C13H17FN2O.ClH/c1-8-7-9(14)5-6-12(8)16-13(17)10-3-2-4-11(10)15;/h5-7,10-11H,2-4,15H2,1H3,(H,16,17);1H
InChIKeyIFCJYQHVVNGKNO-UHFFFAOYSA-N
MW272.75 g/mol
LogP2.62
Rot. Bonds2

About 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride

2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119679603) has the molecular formula C13H18ClFN2O and a molecular weight of 272.75 g/mol. Its IUPAC name is 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119679603
Molecular FormulaC13H18ClFN2O
Molecular Weight272.75 g/mol
Exact Mass272.11
IUPAC Name2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCc1cc(F)ccc1NC(=O)C1CCCC1N.Cl
InChIInChI=1S/C13H17FN2O.ClH/c1-8-7-9(14)5-6-12(8)16-13(17)10-3-2-4-11(10)15;/h5-7,10-11H,2-4,15H2,1H3,(H,16,17);1H
InChIKeyIFCJYQHVVNGKNO-UHFFFAOYSA-N
XLogP2.62
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.75
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2,4-dimethylphenyl)cyclopentane-1-carboxamide
CID 64816599
N-(4-fluoro-2-methylphenyl)cyclobutanecarboxamide
CID 17069288
trans-(1R,2R)-2-[(4-fluoro-2-methylphenyl)carbamoyl]cyclohexane-1-carboxylate
CID 7472991
2-amino-N-(2-methylphenyl)cyclopentane-1-carboxamide
CID 64818336
2-[(2-aminocyclopentanecarbonyl)amino]-4-fluorobenzoic acid
CID 64822060
2-amino-N-(2-methyl-4-nitrophenyl)cyclopentane-1-carboxamide
CID 64824134
2-amino-N-(4-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670661
2-[(2-aminocyclohexanecarbonyl)amino]-4-fluorobenzoic acid
CID 64824996
2-amino-N-[2-methyl-5-(trifluoromethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119706448
N-(5-fluoro-2-methylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110013638
N-(4-fluoro-2-methylphenyl)-2-methylpyrrolidine-3-carboxamide
CID 79383629
2-[(4-fluoro-2-methylphenyl)carbamoylamino]cyclopentane-1-carboxylic acid
CID 64816695

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride (CID 119679603) is 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride is Cc1cc(F)ccc1NC(=O)C1CCCC1N.Cl.
What is the InChIKey of 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is IFCJYQHVVNGKNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O.ClH/c1-8-7-9(14)5-6-12(8)16-13(17)10-3-2-4-11(10)15;/h5-7,10-11H,2-4,15H2,1H3,(H,16,17);1H.
What are the key properties of 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride?
2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 272.75 g/mol, XLogP of 2.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119679603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).