N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide

C11H15ClN2O — CID 60686804

IUPACN-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide
SMILESCNCC(=O)N(C)Cc1ccccc1Cl
InChIInChI=1S/C11H15ClN2O/c1-13-7-11(15)14(2)8-9-5-3-4-6-10(9)12/h3-6,13H,7-8H2,1-2H3
InChIKeyGJGOAFGQNCFWLW-UHFFFAOYSA-N
MW226.71 g/mol
LogP1.52
Rot. Bonds4

About N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide

N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide (PubChem CID 60686804) has the molecular formula C11H15ClN2O and a molecular weight of 226.71 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide
PubChem CID60686804
Molecular FormulaC11H15ClN2O
Molecular Weight226.71 g/mol
Exact Mass226.09
IUPAC NameN-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide
SMILESCNCC(=O)N(C)Cc1ccccc1Cl
InChIInChI=1S/C11H15ClN2O/c1-13-7-11(15)14(2)8-9-5-3-4-6-10(9)12/h3-6,13H,7-8H2,1-2H3
InChIKeyGJGOAFGQNCFWLW-UHFFFAOYSA-N
XLogP1.52
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-chlorophenyl)methyl]-2-(ethylamino)-N-methylacetamide
CID 60685447
N-[(2-chlorophenyl)methyl]-N-methyl-2-(propan-2-ylamino)acetamide
CID 60683172
2-anilino-N-[(2-chlorophenyl)methyl]-N-methylacetamide
CID 60683247
N-[(2-chlorophenyl)methyl]-N-methyl-2-(prop-2-ynylamino)acetamide
CID 78915074
N-[(2-ethoxyphenyl)methyl]-N-methyl-2-(methylamino)acetamide
CID 54873676
N-[(2-chlorophenyl)methyl]-N-cyclopentyl-2-(methylamino)acetamide
CID 119776374
2-(2-aminophenyl)-N-[(2-chlorophenyl)methyl]-N-methylacetamide
CID 61117245
1-[(2-chlorophenyl)methyl]-1-methylurea
CID 60703173
N-[(2-chlorophenyl)methyl]-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605024
N-[(2-chlorophenyl)methyl]-2-(2-chlorophenyl)sulfanyl-N-methylacetamide
CID 112790303
2-(4-bromophenyl)-N-[(2-chlorophenyl)methyl]-N-methylacetamide
CID 55328984
N-[(2-chlorophenyl)methyl]-N,2-dimethylpropanamide;ethane
CID 143072453

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide (CID 60686804) is N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide is CNCC(=O)N(C)Cc1ccccc1Cl.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide?
The InChIKey is GJGOAFGQNCFWLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O/c1-13-7-11(15)14(2)8-9-5-3-4-6-10(9)12/h3-6,13H,7-8H2,1-2H3.
What are the key properties of N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide?
N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide has a molecular weight of 226.71 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-N-methyl-2-(methylamino)acetamide is sourced from PubChem (CID 60686804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).