1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride

C11H13ClF3N — CID 117046880

IUPAC1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride
SMILESCl.NC1(c2c(F)cc(F)cc2F)CCCC1
InChIInChI=1S/C11H12F3N.ClH/c12-7-5-8(13)10(9(14)6-7)11(15)3-1-2-4-11;/h5-6H,1-4,15H2;1H
InChIKeyGMLNHRNPGVBBSO-UHFFFAOYSA-N
MW251.68 g/mol
LogP3.25
Rot. Bonds1

About 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride

1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride (PubChem CID 117046880) has the molecular formula C11H13ClF3N and a molecular weight of 251.68 g/mol. Its IUPAC name is 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride
PubChem CID117046880
Molecular FormulaC11H13ClF3N
Molecular Weight251.68 g/mol
Exact Mass251.07
IUPAC Name1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride
SMILESCl.NC1(c2c(F)cc(F)cc2F)CCCC1
InChIInChI=1S/C11H12F3N.ClH/c12-7-5-8(13)10(9(14)6-7)11(15)3-1-2-4-11;/h5-6H,1-4,15H2;1H
InChIKeyGMLNHRNPGVBBSO-UHFFFAOYSA-N
XLogP3.25
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.68
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,4-difluorophenyl)cyclohexan-1-amine
CID 62802198
4-(1-aminocyclopentyl)-2-bromo-3,5-difluorophenol
CID 117471497
1-(2-fluoro-4,6-dimethoxyphenyl)cyclopentan-1-amine
CID 84799753
2-(1-aminocyclohexyl)-3,4,6-trifluorophenol
CID 117364421
1-(2,5-difluorophenyl)cyclopentan-1-amine
CID 62802401
1-(2-chloro-6-fluoro-4-methoxyphenyl)cyclopentan-1-amine
CID 84802273
1-(2-fluoro-4,6-dimethoxyphenyl)cyclohexan-1-amine
CID 117386080
1-(5-bromo-2,4-difluorophenyl)cyclopentan-1-amine
CID 84810883
1-(5,7-difluoro-1H-indol-6-yl)cyclopentan-1-amine
CID 117344483
1-(4,6-difluoro-1H-benzimidazol-2-yl)cycloheptan-1-amine
CID 81449334
1-(3,5-difluorophenyl)cyclopropan-1-amine;hydrochloride
CID 50944250
1-(3-fluoro-2,6-dimethylphenyl)cyclopentan-1-amine
CID 84779827

Frequently Asked Questions

What is the IUPAC name of 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride?
The IUPAC name of 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride (CID 117046880) is 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride.
What is the SMILES notation for 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride?
The canonical SMILES for 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride is Cl.NC1(c2c(F)cc(F)cc2F)CCCC1.
What is the InChIKey of 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride?
The InChIKey is GMLNHRNPGVBBSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F3N.ClH/c12-7-5-8(13)10(9(14)6-7)11(15)3-1-2-4-11;/h5-6H,1-4,15H2;1H.
What are the key properties of 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride?
1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride has a molecular weight of 251.68 g/mol, XLogP of 3.25, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4,6-trifluorophenyl)cyclopentan-1-amine;hydrochloride is sourced from PubChem (CID 117046880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).