2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide

C15H21BrN2O — CID 64683694

IUPAC2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide
SMILESCN(Cc1ccc(Br)cc1)C(=O)CC1(N)CCCC1
InChIInChI=1S/C15H21BrN2O/c1-18(11-12-4-6-13(16)7-5-12)14(19)10-15(17)8-2-3-9-15/h4-7H,2-3,8-11,17H2,1H3
InChIKeyLGETVQMZBDYHRE-UHFFFAOYSA-N
MW325.25 g/mol
LogP3.07
Rot. Bonds4

About 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide

2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide (PubChem CID 64683694) has the molecular formula C15H21BrN2O and a molecular weight of 325.25 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide
PubChem CID64683694
Molecular FormulaC15H21BrN2O
Molecular Weight325.25 g/mol
Exact Mass324.08
IUPAC Name2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide
SMILESCN(Cc1ccc(Br)cc1)C(=O)CC1(N)CCCC1
InChIInChI=1S/C15H21BrN2O/c1-18(11-12-4-6-13(16)7-5-12)14(19)10-15(17)8-2-3-9-15/h4-7H,2-3,8-11,17H2,1H3
InChIKeyLGETVQMZBDYHRE-UHFFFAOYSA-N
XLogP3.07
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.25
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-aminocyclopentyl)-N-[(4-methoxyphenyl)methyl]-N-methylacetamide
CID 64684478
2-(1-aminocyclobutyl)-N-[[4-(dimethylamino)phenyl]methyl]-N-methylacetamide
CID 79853909
2-(1-aminocyclopentyl)-N-methyl-N-(pyridin-4-ylmethyl)acetamide
CID 64684189
2-[1-(aminomethyl)cyclohexyl]-N-[(4-bromophenyl)methyl]-N-methylacetamide
CID 104677766
2-(1-aminocyclobutyl)-N-[(4-cyanophenyl)methyl]-N-methylacetamide
CID 79853828
2-(1-aminocyclopentyl)-N-[(3,4-dichlorophenyl)methyl]-N-methylacetamide
CID 64685068
2-(1-aminocyclobutyl)-N-methyl-N-(naphthalen-2-ylmethyl)acetamide
CID 79843799
2-(1-aminocyclobutyl)-N-methyl-N-[(3-methylphenyl)methyl]acetamide
CID 79854781
2-(1-aminocyclobutyl)-N-[(4-bromothiophen-2-yl)methyl]-N-methylacetamide;hydrochloride
CID 75424655
N-[(4-bromophenyl)methyl]-N,1-dimethylcyclohexane-1-carboxamide
CID 104985630
N-[(4-bromophenyl)methyl]-2-hydroxy-N-methylacetamide
CID 82132454
2-(1-aminocyclohexyl)-N-[(3-methoxyphenyl)methyl]-N-methylacetamide
CID 64684867

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide (CID 64683694) is 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide is CN(Cc1ccc(Br)cc1)C(=O)CC1(N)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide?
The InChIKey is LGETVQMZBDYHRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21BrN2O/c1-18(11-12-4-6-13(16)7-5-12)14(19)10-15(17)8-2-3-9-15/h4-7H,2-3,8-11,17H2,1H3.
What are the key properties of 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide?
2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide has a molecular weight of 325.25 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-[(4-bromophenyl)methyl]-N-methylacetamide is sourced from PubChem (CID 64683694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).