1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride

C11H15Cl2N — CID 47002947

IUPAC1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride
SMILESCl.NC1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C11H14ClN.ClH/c12-10-5-3-9(4-6-10)11(13)7-1-2-8-11;/h3-6H,1-2,7-8,13H2;1H
InChIKeyGWANQHWNKPKGCD-UHFFFAOYSA-N
MW232.15 g/mol
LogP3.49
Rot. Bonds1

About 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride

1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride (PubChem CID 47002947) has the molecular formula C11H15Cl2N and a molecular weight of 232.15 g/mol. Its IUPAC name is 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride
PubChem CID47002947
Molecular FormulaC11H15Cl2N
Molecular Weight232.15 g/mol
Exact Mass231.06
IUPAC Name1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride
SMILESCl.NC1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C11H14ClN.ClH/c12-10-5-3-9(4-6-10)11(13)7-1-2-8-11;/h3-6H,1-2,7-8,13H2;1H
InChIKeyGWANQHWNKPKGCD-UHFFFAOYSA-N
XLogP3.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.15
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-methylphenyl)cyclopentan-1-amine;hydrochloride
CID 45380293
1-(3-chloro-4-fluorophenyl)cyclobutan-1-amine;hydrochloride
CID 129033048
1-(4-iodophenyl)cyclopentan-1-amine
CID 117047029
1-(3,4-dichlorophenyl)cycloheptan-1-amine
CID 43164287
1-(4-chlorophenyl)-3,3-dimethylcyclobutan-1-amine
CID 65000826
1-(4-chlorophenyl)-4-phenylcyclohexan-1-amine
CID 63407795
1-(4-chloro-3-fluorophenyl)cyclobutan-1-amine
CID 82607558
1-(4-propan-2-ylphenyl)cyclobutan-1-amine
CID 43146614
3-amino-3-(4-chlorophenyl)-1-methylcyclopentan-1-ol
CID 115035314
1-(4-fluoro-3-methylphenyl)cyclohexan-1-amine
CID 23289263
1-chloro-4-[1-[1-(4-chlorophenyl)cyclobutyl]cyclobutyl]benzene
CID 91148792
1-[1-(4-chlorophenyl)cyclopentyl]ethanamine
CID 83691849

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride?
The IUPAC name of 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride (CID 47002947) is 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride.
What is the SMILES notation for 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride?
The canonical SMILES for 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride is Cl.NC1(c2ccc(Cl)cc2)CCCC1.
What is the InChIKey of 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride?
The InChIKey is GWANQHWNKPKGCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN.ClH/c12-10-5-3-9(4-6-10)11(13)7-1-2-8-11;/h3-6H,1-2,7-8,13H2;1H.
What are the key properties of 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride?
1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride has a molecular weight of 232.15 g/mol, XLogP of 3.49, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)cyclopentan-1-amine;hydrochloride is sourced from PubChem (CID 47002947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).