2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide

C15H16ClNO — CID 115162099

IUPAC2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide
SMILESCc1ccc2cc(CN(C)C(=O)CCl)ccc2c1
InChIInChI=1S/C15H16ClNO/c1-11-3-5-14-8-12(4-6-13(14)7-11)10-17(2)15(18)9-16/h3-8H,9-10H2,1-2H3
InChIKeyIMWIYMMVZDURHL-UHFFFAOYSA-N
MW261.75 g/mol
LogP3.35
Rot. Bonds3

About 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide

2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide (PubChem CID 115162099) has the molecular formula C15H16ClNO and a molecular weight of 261.75 g/mol. Its IUPAC name is 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide
PubChem CID115162099
Molecular FormulaC15H16ClNO
Molecular Weight261.75 g/mol
Exact Mass261.09
IUPAC Name2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide
SMILESCc1ccc2cc(CN(C)C(=O)CCl)ccc2c1
InChIInChI=1S/C15H16ClNO/c1-11-3-5-14-8-12(4-6-13(14)7-11)10-17(2)15(18)9-16/h3-8H,9-10H2,1-2H3
InChIKeyIMWIYMMVZDURHL-UHFFFAOYSA-N
XLogP3.35
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.75
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide 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

2-chloro-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 2450177
N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]-2-oxoacetamide
CID 115166473
2-chloro-N-[(3,4-difluorophenyl)methyl]-N-methylacetamide
CID 60948624
2-chloro-N-[(3-ethylphenyl)methyl]-N-methylacetamide
CID 162420357
2-hydroxy-N-methyl-N-[2-(6-methylnaphthalen-2-yl)ethyl]acetamide
CID 115140233
2-chloro-N-methyl-N-[(4-phenylphenyl)methyl]acetamide
CID 166403235
4-[[(2-chloroacetyl)-methylamino]methyl]benzamide
CID 60812217
N-[(4-chlorophenyl)methyl]-2-(2,4-dimethylphenyl)-N-methylacetamide
CID 100559271
3-amino-N-methyl-N-(naphthalen-2-ylmethyl)propanamide;hydrochloride
CID 119270375
2-hydroxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylacetamide
CID 115140024
1-N-methyl-1-N-[(6-methylnaphthalen-2-yl)methyl]butane-1,3-diamine
CID 115199467
2-(6-methylnaphthalen-2-yl)acetic acid
CID 13199360

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide?
The IUPAC name of 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide (CID 115162099) is 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide.
What is the SMILES notation for 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide?
The canonical SMILES for 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide is Cc1ccc2cc(CN(C)C(=O)CCl)ccc2c1.
What is the InChIKey of 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide?
The InChIKey is IMWIYMMVZDURHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO/c1-11-3-5-14-8-12(4-6-13(14)7-11)10-17(2)15(18)9-16/h3-8H,9-10H2,1-2H3.
What are the key properties of 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide?
2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide has a molecular weight of 261.75 g/mol, XLogP of 3.35, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-methyl-N-[(6-methylnaphthalen-2-yl)methyl]acetamide is sourced from PubChem (CID 115162099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).