(1R)-1-(2-bromophenyl)pentan-1-amine

C11H16BrN — CID 171198050

IUPAC(1R)-1-(2-bromophenyl)pentan-1-amine
SMILESCCCC[C@@H](N)c1ccccc1Br
InChIInChI=1S/C11H16BrN/c1-2-3-8-11(13)9-6-4-5-7-10(9)12/h4-7,11H,2-3,8,13H2,1H3/t11-/m1/s1
InChIKeyNHAVFWOESZJBJZ-LLVKDONJSA-N
MW242.16 g/mol
LogP3.64
Rot. Bonds4

About (1R)-1-(2-bromophenyl)pentan-1-amine

(1R)-1-(2-bromophenyl)pentan-1-amine (PubChem CID 171198050) has the molecular formula C11H16BrN and a molecular weight of 242.16 g/mol. Its IUPAC name is (1R)-1-(2-bromophenyl)pentan-1-amine.

Molecular Properties

Compound Name(1R)-1-(2-bromophenyl)pentan-1-amine
PubChem CID171198050
Molecular FormulaC11H16BrN
Molecular Weight242.16 g/mol
Exact Mass241.05
IUPAC Name(1R)-1-(2-bromophenyl)pentan-1-amine
SMILESCCCC[C@@H](N)c1ccccc1Br
InChIInChI=1S/C11H16BrN/c1-2-3-8-11(13)9-6-4-5-7-10(9)12/h4-7,11H,2-3,8,13H2,1H3/t11-/m1/s1
InChIKeyNHAVFWOESZJBJZ-LLVKDONJSA-N
XLogP3.64
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.16
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-bromophenyl)hexan-1-amine
CID 62604682
(4S)-4-amino-4-(2-bromophenyl)butan-1-ol;hydrochloride
CID 171217585
1-(2-propan-2-ylphenyl)pentan-1-amine
CID 171922235
1-(3-bromo-2-methylphenyl)octan-1-amine
CID 115832299
3-[(1S)-1-aminopentyl]-4-bromophenol
CID 171223086
2-[(1R)-1-aminohexyl]-6-bromophenol;hydrochloride
CID 171202780
1-(3-bromo-2-fluorophenyl)undecan-1-amine
CID 107952817
(1R)-1-(2-bromo-4-fluorophenyl)pentan-1-amine;hydrochloride
CID 171201221
(1R)-1-(2-bromo-5-fluorophenyl)pentan-1-amine;hydrochloride
CID 171202646
[2-[(1R)-1-aminopentyl]phenyl]methanol
CID 55297220
1-(2-bromophenyl)-N'-methyl-N'-pentan-3-ylpropane-1,3-diamine
CID 62629071
1-bromo-2-heptan-2-ylbenzene
CID 59216916

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-bromophenyl)pentan-1-amine?
The IUPAC name of (1R)-1-(2-bromophenyl)pentan-1-amine (CID 171198050) is (1R)-1-(2-bromophenyl)pentan-1-amine.
What is the SMILES notation for (1R)-1-(2-bromophenyl)pentan-1-amine?
The canonical SMILES for (1R)-1-(2-bromophenyl)pentan-1-amine is CCCC[C@@H](N)c1ccccc1Br.
What is the InChIKey of (1R)-1-(2-bromophenyl)pentan-1-amine?
The InChIKey is NHAVFWOESZJBJZ-LLVKDONJSA-N. The full InChI is InChI=1S/C11H16BrN/c1-2-3-8-11(13)9-6-4-5-7-10(9)12/h4-7,11H,2-3,8,13H2,1H3/t11-/m1/s1.
What are the key properties of (1R)-1-(2-bromophenyl)pentan-1-amine?
(1R)-1-(2-bromophenyl)pentan-1-amine has a molecular weight of 242.16 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-bromophenyl)pentan-1-amine is sourced from PubChem (CID 171198050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).