2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide

C12H18N2O — CID 82492265

IUPAC2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide
SMILESCc1ccc(CCNC(=O)CN)cc1C
InChIInChI=1S/C12H18N2O/c1-9-3-4-11(7-10(9)2)5-6-14-12(15)8-13/h3-4,7H,5-6,8,13H2,1-2H3,(H,14,15)
InChIKeyVOQJYQQYXUXNSB-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.92
Rot. Bonds4

About 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide

2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide (PubChem CID 82492265) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide
PubChem CID82492265
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide
SMILESCc1ccc(CCNC(=O)CN)cc1C
InChIInChI=1S/C12H18N2O/c1-9-3-4-11(7-10(9)2)5-6-14-12(15)8-13/h3-4,7H,5-6,8,13H2,1-2H3,(H,14,15)
InChIKeyVOQJYQQYXUXNSB-UHFFFAOYSA-N
XLogP0.92
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]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

N-[2-(3,4-dimethylphenyl)ethyl]-3-oxobutanamide
CID 115176506
2-amino-N-[2-(3-methoxy-4-methylphenyl)ethyl]acetamide
CID 119326320
3-amino-N-[2-(3,4-dimethylphenyl)ethyl]butanamide
CID 115154307
2-amino-N-[2-(4-ethylphenyl)ethyl]acetamide
CID 94681068
ethyl N-[2-(3,4-dimethylphenyl)ethyl]carbamate
CID 110787279
2-amino-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]acetamide
CID 82495829
2-(aminomethyl)-N-[2-(3,4-dimethylphenyl)ethyl]butanamide
CID 115187036
2-amino-N-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]acetamide
CID 60848971
1-[2-(3,4-dimethylphenyl)ethyl]-3-propylurea
CID 110775625
2-amino-3-[2-(3,4-dimethylphenyl)ethylamino]-3-oxopropanoic acid
CID 115179434
2-chloro-N-[2-(3,4-dimethylphenyl)ethyl]propanamide
CID 82110156
2-amino-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22690352

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide?
The IUPAC name of 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide (CID 82492265) is 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide is Cc1ccc(CCNC(=O)CN)cc1C.
What is the InChIKey of 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide?
The InChIKey is VOQJYQQYXUXNSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-3-4-11(7-10(9)2)5-6-14-12(15)8-13/h3-4,7H,5-6,8,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide?
2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide has a molecular weight of 206.29 g/mol, XLogP of 0.92, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(3,4-dimethylphenyl)ethyl]acetamide is sourced from PubChem (CID 82492265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).