2-chloro-N-methyl-2-(3-methylphenyl)acetamide

C10H12ClNO — CID 62224564

IUPAC2-chloro-N-methyl-2-(3-methylphenyl)acetamide
SMILESCNC(=O)C(Cl)c1cccc(C)c1
InChIInChI=1S/C10H12ClNO/c1-7-4-3-5-8(6-7)9(11)10(13)12-2/h3-6,9H,1-2H3,(H,12,13)
InChIKeyFUTWNYLXBSYQEB-UHFFFAOYSA-N
MW197.66 g/mol
LogP2.02
Rot. Bonds2

About 2-chloro-N-methyl-2-(3-methylphenyl)acetamide

2-chloro-N-methyl-2-(3-methylphenyl)acetamide (PubChem CID 62224564) has the molecular formula C10H12ClNO and a molecular weight of 197.66 g/mol. Its IUPAC name is 2-chloro-N-methyl-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-methyl-2-(3-methylphenyl)acetamide
PubChem CID62224564
Molecular FormulaC10H12ClNO
Molecular Weight197.66 g/mol
Exact Mass197.06
IUPAC Name2-chloro-N-methyl-2-(3-methylphenyl)acetamide
SMILESCNC(=O)C(Cl)c1cccc(C)c1
InChIInChI=1S/C10H12ClNO/c1-7-4-3-5-8(6-7)9(11)10(13)12-2/h3-6,9H,1-2H3,(H,12,13)
InChIKeyFUTWNYLXBSYQEB-UHFFFAOYSA-N
XLogP2.02
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.66
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-2-(3-methoxyphenyl)-N-methylacetamide
CID 10036152
2-chloro-N-methyl-2-(3-propan-2-yloxyphenyl)acetamide
CID 62225305
1-chloro-1-(3-methylphenyl)butan-2-one
CID 82161739
ethyl 2-chloro-2-(3-methylphenyl)acetate
CID 22600133
N-acetyl-2-chloro-N-hydroxy-2-(3-methylphenyl)acetamide
CID 12623358
3-methyl-2-(3-methylphenyl)butanoyl chloride
CID 23465341
2-chloro-2-(3,5-dichlorophenyl)-N-methylacetamide
CID 62225121
2-chloro-2-(4-fluorophenyl)-N-methylacetamide
CID 10352801
2-chloro-2-(2-fluoro-3-methylphenyl)-N-methylacetamide
CID 130992769
2-chloro-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide
CID 4969220
2-cyano-N-(3,5-dimethylphenyl)-N'-(3-methylphenyl)propanediamide
CID 144523280
1,1-bis(3-methylphenyl)propan-2-one;ethane
CID 145153760

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-methyl-2-(3-methylphenyl)acetamide?
The IUPAC name of 2-chloro-N-methyl-2-(3-methylphenyl)acetamide (CID 62224564) is 2-chloro-N-methyl-2-(3-methylphenyl)acetamide.
What is the SMILES notation for 2-chloro-N-methyl-2-(3-methylphenyl)acetamide?
The canonical SMILES for 2-chloro-N-methyl-2-(3-methylphenyl)acetamide is CNC(=O)C(Cl)c1cccc(C)c1.
What is the InChIKey of 2-chloro-N-methyl-2-(3-methylphenyl)acetamide?
The InChIKey is FUTWNYLXBSYQEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO/c1-7-4-3-5-8(6-7)9(11)10(13)12-2/h3-6,9H,1-2H3,(H,12,13).
What are the key properties of 2-chloro-N-methyl-2-(3-methylphenyl)acetamide?
2-chloro-N-methyl-2-(3-methylphenyl)acetamide has a molecular weight of 197.66 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-methyl-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 62224564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).