3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide

C14H19BrN2O — CID 81376252

IUPAC3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide
SMILESC[C@@H](NC(=O)C1CCC(N)C1)c1cccc(Br)c1
InChIInChI=1S/C14H19BrN2O/c1-9(10-3-2-4-12(15)7-10)17-14(18)11-5-6-13(16)8-11/h2-4,7,9,11,13H,5-6,8,16H2,1H3,(H,17,18)/t9-,11?,13?/m1/s1
InChIKeyCSWUPUYECLKVDS-CBZQXFMTSA-N
MW311.22 g/mol
LogP2.75
Rot. Bonds3

About 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide

3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide (PubChem CID 81376252) has the molecular formula C14H19BrN2O and a molecular weight of 311.22 g/mol. Its IUPAC name is 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide
PubChem CID81376252
Molecular FormulaC14H19BrN2O
Molecular Weight311.22 g/mol
Exact Mass310.07
IUPAC Name3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide
SMILESC[C@@H](NC(=O)C1CCC(N)C1)c1cccc(Br)c1
InChIInChI=1S/C14H19BrN2O/c1-9(10-3-2-4-12(15)7-10)17-14(18)11-5-6-13(16)8-11/h2-4,7,9,11,13H,5-6,8,16H2,1H3,(H,17,18)/t9-,11?,13?/m1/s1
InChIKeyCSWUPUYECLKVDS-CBZQXFMTSA-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

Analyze 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-N-[(1S)-1-(3-bromophenyl)ethyl]cyclohexane-1-carboxamide
CID 81376555
3-amino-N-[(1S)-1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81365977
3-amino-N-[1-(3-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 66008581
3-amino-N-[1-[3-(trifluoromethyl)phenyl]ethyl]cyclopentane-1-carboxamide
CID 66009151
3-amino-N-[1-(3-pyrazol-1-ylphenyl)ethyl]cyclopentane-1-carboxamide;hydrochloride
CID 119788707
3-amino-N-[(1S)-1-pyridin-3-ylethyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119863798
2-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide
CID 81376546
4-amino-N-[1-(3-chlorophenyl)ethyl]cyclohexane-1-carboxamide
CID 54913905
4-amino-N-[(1R)-1-(3-chlorophenyl)ethyl]cyclohexane-1-carboxamide
CID 81371570
3-amino-N-[1-(3,4-dimethoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 66010445
3-amino-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 81350102
N-[1-(3-bromophenyl)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119285498

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide (CID 81376252) is 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide is C[C@@H](NC(=O)C1CCC(N)C1)c1cccc(Br)c1.
What is the InChIKey of 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is CSWUPUYECLKVDS-CBZQXFMTSA-N. The full InChI is InChI=1S/C14H19BrN2O/c1-9(10-3-2-4-12(15)7-10)17-14(18)11-5-6-13(16)8-11/h2-4,7,9,11,13H,5-6,8,16H2,1H3,(H,17,18)/t9-,11?,13?/m1/s1.
What are the key properties of 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide?
3-amino-N-[(1R)-1-(3-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 3-amino-N-[(1R)-1-(3-bromophenyl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 81376252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).