1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride

C11H15BrClN — CID 171935306

IUPAC1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride
SMILESCl.NC1(c2ccccc2Br)CCCC1
InChIInChI=1S/C11H14BrN.ClH/c12-10-6-2-1-5-9(10)11(13)7-3-4-8-11;/h1-2,5-6H,3-4,7-8,13H2;1H
InChIKeyDZAXWDDAOCWWIP-UHFFFAOYSA-N
MW276.60 g/mol
LogP3.60
Rot. Bonds1

About 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride

1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride (PubChem CID 171935306) has the molecular formula C11H15BrClN and a molecular weight of 276.60 g/mol. Its IUPAC name is 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride
PubChem CID171935306
Molecular FormulaC11H15BrClN
Molecular Weight276.60 g/mol
Exact Mass275.01
IUPAC Name1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride
SMILESCl.NC1(c2ccccc2Br)CCCC1
InChIInChI=1S/C11H14BrN.ClH/c12-10-6-2-1-5-9(10)11(13)7-3-4-8-11;/h1-2,5-6H,3-4,7-8,13H2;1H
InChIKeyDZAXWDDAOCWWIP-UHFFFAOYSA-N
XLogP3.60
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.60
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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1-(3-bromo-2-methoxyphenyl)cyclopropan-1-amine
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1-(2-bromophenyl)-N,N-dimethylcyclopentan-1-amine
CID 115049925
1-[2-(1-fluorocyclohexyl)phenyl]cyclopropan-1-amine
CID 84726857
1-[2-(difluoromethyl)phenyl]cyclohexan-1-amine
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1-(2-tert-butylphenyl)cyclohexan-1-amine
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Frequently Asked Questions

What is the IUPAC name of 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride?
The IUPAC name of 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride (CID 171935306) is 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride.
What is the SMILES notation for 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride?
The canonical SMILES for 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride is Cl.NC1(c2ccccc2Br)CCCC1.
What is the InChIKey of 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride?
The InChIKey is DZAXWDDAOCWWIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN.ClH/c12-10-6-2-1-5-9(10)11(13)7-3-4-8-11;/h1-2,5-6H,3-4,7-8,13H2;1H.
What are the key properties of 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride?
1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride has a molecular weight of 276.60 g/mol, XLogP of 3.60, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride is sourced from PubChem (CID 171935306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).