2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine

C19H22BrN — CID 63417762

IUPAC2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine
SMILESNC(Cc1ccccc1Br)C1(c2ccccc2)CCCC1
InChIInChI=1S/C19H22BrN/c20-17-11-5-4-8-15(17)14-18(21)19(12-6-7-13-19)16-9-2-1-3-10-16/h1-5,8-11,18H,6-7,12-14,21H2
InChIKeyXJAAMJSPLWNCPD-UHFFFAOYSA-N
MW344.30 g/mol
LogP4.83
Rot. Bonds4

About 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine

2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine (PubChem CID 63417762) has the molecular formula C19H22BrN and a molecular weight of 344.30 g/mol. Its IUPAC name is 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine.

Molecular Properties

Compound Name2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine
PubChem CID63417762
Molecular FormulaC19H22BrN
Molecular Weight344.30 g/mol
Exact Mass343.09
IUPAC Name2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine
SMILESNC(Cc1ccccc1Br)C1(c2ccccc2)CCCC1
InChIInChI=1S/C19H22BrN/c20-17-11-5-4-8-15(17)14-18(21)19(12-6-7-13-19)16-9-2-1-3-10-16/h1-5,8-11,18H,6-7,12-14,21H2
InChIKeyXJAAMJSPLWNCPD-UHFFFAOYSA-N
XLogP4.83
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.30
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[1-amino-2-(2-bromophenyl)ethyl]-N,N-dimethylcyclohexan-1-amine
CID 79066221
2-(5-bromothiophen-2-yl)-1-(1-phenylcyclohexyl)ethanamine
CID 63417582
2-(3-bromothiophen-2-yl)-1-(1-phenylcyclohexyl)ethanamine
CID 63417719
2-(2-bromophenyl)-N-methyl-1-(1-phenylcyclopropyl)ethanamine
CID 63080919
2-(2-chloro-3-fluorophenyl)-1-(1-phenylcyclobutyl)ethanamine
CID 115983760
3-methyl-1-(1-phenylcyclopentyl)butan-1-amine
CID 63080300
2-(4-fluoro-2-methylphenyl)-1-(1-phenylcyclobutyl)ethanamine
CID 114347866
2-(2-bromophenyl)-1-(4-methoxyoxan-4-yl)ethanamine
CID 116764497
1-(1-phenylcyclohexyl)-2-propan-2-yloxyethanamine
CID 79574267
1-[(2-bromophenyl)methyl]cyclooctan-1-amine
CID 80603079
1-(1-phenylcyclopentyl)ethanamine;hydrochloride
CID 75466877
(1R)-1-(1-phenylcyclohexyl)ethanamine
CID 78998571

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine?
The IUPAC name of 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine (CID 63417762) is 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine.
What is the SMILES notation for 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine?
The canonical SMILES for 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine is NC(Cc1ccccc1Br)C1(c2ccccc2)CCCC1.
What is the InChIKey of 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine?
The InChIKey is XJAAMJSPLWNCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22BrN/c20-17-11-5-4-8-15(17)14-18(21)19(12-6-7-13-19)16-9-2-1-3-10-16/h1-5,8-11,18H,6-7,12-14,21H2.
What are the key properties of 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine?
2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine has a molecular weight of 344.30 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-1-(1-phenylcyclopentyl)ethanamine is sourced from PubChem (CID 63417762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).