N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide

C15H21BrN2O — CID 107418146

IUPACN-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide
SMILESCC1CCCC1CNCC(=O)Nc1cccc(Br)c1
InChIInChI=1S/C15H21BrN2O/c1-11-4-2-5-12(11)9-17-10-15(19)18-14-7-3-6-13(16)8-14/h3,6-8,11-12,17H,2,4-5,9-10H2,1H3,(H,18,19)
InChIKeyCDHBEXNYECZQPJ-UHFFFAOYSA-N
MW325.25 g/mol
LogP3.41
Rot. Bonds5

About N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide

N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide (PubChem CID 107418146) has the molecular formula C15H21BrN2O and a molecular weight of 325.25 g/mol. Its IUPAC name is N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide
PubChem CID107418146
Molecular FormulaC15H21BrN2O
Molecular Weight325.25 g/mol
Exact Mass324.08
IUPAC NameN-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide
SMILESCC1CCCC1CNCC(=O)Nc1cccc(Br)c1
InChIInChI=1S/C15H21BrN2O/c1-11-4-2-5-12(11)9-17-10-15(19)18-14-7-3-6-13(16)8-14/h3,6-8,11-12,17H,2,4-5,9-10H2,1H3,(H,18,19)
InChIKeyCDHBEXNYECZQPJ-UHFFFAOYSA-N
XLogP3.41
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.25
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 107418229
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CID 62976482
N-(3-bromophenyl)-2-[(1-ethylpyrrolidin-3-yl)methylamino]acetamide
CID 60857365
N-(3-bromophenyl)-2-[(2,3-dimethylcyclopentyl)amino]acetamide
CID 64909334
N-(3-bromophenyl)-2-(2-cyclohexylethylamino)acetamide
CID 60920962
N-(3-bromophenyl)-2-[(3,4-dimethylcyclohexyl)amino]acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide?
The IUPAC name of N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide (CID 107418146) is N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide.
What is the SMILES notation for N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide?
The canonical SMILES for N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide is CC1CCCC1CNCC(=O)Nc1cccc(Br)c1.
What is the InChIKey of N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide?
The InChIKey is CDHBEXNYECZQPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21BrN2O/c1-11-4-2-5-12(11)9-17-10-15(19)18-14-7-3-6-13(16)8-14/h3,6-8,11-12,17H,2,4-5,9-10H2,1H3,(H,18,19).
What are the key properties of N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide?
N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide has a molecular weight of 325.25 g/mol, XLogP of 3.41, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-2-[(2-methylcyclopentyl)methylamino]acetamide is sourced from PubChem (CID 107418146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).