2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide

C14H19BrN2O — CID 64823134

IUPAC2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide
SMILESCC(NC(=O)C1CCCC1N)c1ccccc1Br
InChIInChI=1S/C14H19BrN2O/c1-9(10-5-2-3-7-12(10)15)17-14(18)11-6-4-8-13(11)16/h2-3,5,7,9,11,13H,4,6,8,16H2,1H3,(H,17,18)
InChIKeyVMUWSBYFSWFUHP-UHFFFAOYSA-N
MW311.22 g/mol
LogP2.75
Rot. Bonds3

About 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide

2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide (PubChem CID 64823134) has the molecular formula C14H19BrN2O and a molecular weight of 311.22 g/mol. Its IUPAC name is 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide
PubChem CID64823134
Molecular FormulaC14H19BrN2O
Molecular Weight311.22 g/mol
Exact Mass310.07
IUPAC Name2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide
SMILESCC(NC(=O)C1CCCC1N)c1ccccc1Br
InChIInChI=1S/C14H19BrN2O/c1-9(10-5-2-3-7-12(10)15)17-14(18)11-6-4-8-13(11)16/h2-3,5,7,9,11,13H,4,6,8,16H2,1H3,(H,17,18)
InChIKeyVMUWSBYFSWFUHP-UHFFFAOYSA-N
XLogP2.75
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.22
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(aminomethyl)-N-[(1R)-1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide
CID 81384002
2-amino-N-[(1S)-1-(2-methylphenyl)ethyl]cyclopentane-1-carboxamide
CID 81380549
2-amino-N-[(1R)-1-(2-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81377637
2-amino-N-[1-(2-methoxyphenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119683016
2-amino-N-[(1S)-1-phenylethyl]cyclopentane-1-carboxamide
CID 64851455
N-[(1R)-1-(2-bromophenyl)ethyl]cyclopropanecarboxamide
CID 9220068
N-[1-(2-bromophenyl)ethyl]cyclopropanecarboxamide
CID 18111915
2-amino-N-[(1R)-1-phenylethyl]cyclohexane-1-carboxamide
CID 79001242
2-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide
CID 81376546
2-amino-N-[(1R)-1-pyridin-2-ylethyl]cyclopentane-1-carboxamide
CID 81407618
(1S,6R)-6-[[(1S)-1-(2-bromophenyl)ethyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 103881146
2-amino-N-(1-thiophen-2-ylethyl)cyclopentane-1-carboxamide
CID 64822918

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide (CID 64823134) is 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide is CC(NC(=O)C1CCCC1N)c1ccccc1Br.
What is the InChIKey of 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is VMUWSBYFSWFUHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2O/c1-9(10-5-2-3-7-12(10)15)17-14(18)11-6-4-8-13(11)16/h2-3,5,7,9,11,13H,4,6,8,16H2,1H3,(H,17,18).
What are the key properties of 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide?
2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 311.22 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(2-bromophenyl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64823134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).