N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide

C11H15BrN2O — CID 110479783

IUPACN-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)NCc1ccccc1Br
InChIInChI=1S/C11H15BrN2O/c1-14(2)8-11(15)13-7-9-5-3-4-6-10(9)12/h3-6H,7-8H2,1-2H3,(H,13,15)
InChIKeyGDUWAIMVRHDHCR-UHFFFAOYSA-N
MW271.16 g/mol
LogP1.63
Rot. Bonds4

About N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide

N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide (PubChem CID 110479783) has the molecular formula C11H15BrN2O and a molecular weight of 271.16 g/mol. Its IUPAC name is N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide.

Molecular Properties

Compound NameN-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide
PubChem CID110479783
Molecular FormulaC11H15BrN2O
Molecular Weight271.16 g/mol
Exact Mass270.04
IUPAC NameN-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide
SMILESCN(C)CC(=O)NCc1ccccc1Br
InChIInChI=1S/C11H15BrN2O/c1-14(2)8-11(15)13-7-9-5-3-4-6-10(9)12/h3-6H,7-8H2,1-2H3,(H,13,15)
InChIKeyGDUWAIMVRHDHCR-UHFFFAOYSA-N
XLogP1.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-bromophenyl)methyl]-2-hydroxyacetamide
CID 115139901
N-[(2-bromophenyl)methyl]acetamide
CID 2824953
2-[(2-bromophenyl)methylcarbamoyl-methylamino]acetic acid
CID 61414155
2-[(2-bromophenyl)methylcarbamoyl-(carboxymethyl)amino]acetic acid
CID 63644952
3-amino-N-[(2-bromophenyl)methyl]butanamide
CID 61402410
N-[(2-bromophenyl)methyl]-2-(tert-butylamino)acetamide
CID 112727459
N-[(2-bromophenyl)methyl]-2-oxopropanamide
CID 110478310
5-[(2-bromophenyl)methylamino]-3,3-dimethyl-5-oxopentanoic acid
CID 62048219
N-(2-bromophenyl)-2-(dimethylamino)acetamide;hydrochloride
CID 2959503
N-[(2-bromophenyl)methyl]-3-(4-methylphenyl)propanamide
CID 60739656
2-[(2-bromophenyl)methyl-methylamino]-N-[[4-(methoxymethyl)phenyl]methyl]acetamide
CID 87013075
2-[(2-bromophenyl)methylcarbamoyl-tert-butylamino]acetic acid
CID 79257084

Frequently Asked Questions

What is the IUPAC name of N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide?
The IUPAC name of N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide (CID 110479783) is N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide.
What is the SMILES notation for N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide?
The canonical SMILES for N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide is CN(C)CC(=O)NCc1ccccc1Br.
What is the InChIKey of N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide?
The InChIKey is GDUWAIMVRHDHCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O/c1-14(2)8-11(15)13-7-9-5-3-4-6-10(9)12/h3-6H,7-8H2,1-2H3,(H,13,15).
What are the key properties of N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide?
N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide has a molecular weight of 271.16 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromophenyl)methyl]-2-(dimethylamino)acetamide is sourced from PubChem (CID 110479783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).