2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide

C15H20N2O2 — CID 115175020

IUPAC2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide
SMILESCOc1cc(C)c(C)cc1N(C)C(=O)C(C)(C)C#N
InChIInChI=1S/C15H20N2O2/c1-10-7-12(13(19-6)8-11(10)2)17(5)14(18)15(3,4)9-16/h7-8H,1-6H3
InChIKeyCYMGSBYPBPOMIT-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.82
Rot. Bonds3

About 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide

2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide (PubChem CID 115175020) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide.

Molecular Properties

Compound Name2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide
PubChem CID115175020
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide
SMILESCOc1cc(C)c(C)cc1N(C)C(=O)C(C)(C)C#N
InChIInChI=1S/C15H20N2O2/c1-10-7-12(13(19-6)8-11(10)2)17(5)14(18)15(3,4)9-16/h7-8H,1-6H3
InChIKeyCYMGSBYPBPOMIT-UHFFFAOYSA-N
XLogP2.82
TPSA53.33 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide 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-hydroxy-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide
CID 115178640
N-(2-methoxy-4,5-dimethylphenyl)-N-methylacetamide
CID 115190996
2,2,2-trifluoro-N-(4-methoxy-2,5-dimethylphenyl)-N-methylacetamide
CID 115190174
3-(2-methoxy-4,5-dimethylphenyl)-2,2-dimethyl-3-oxopropanenitrile
CID 116919330
2-cyano-N-[(4-methoxy-3-methylphenyl)methyl]-N,2-dimethylpropanamide
CID 115175144
3-(4-methoxy-2,3,6-trimethylphenyl)-2,2-dimethyl-3-oxopropanenitrile
CID 116919415
3-amino-N-(4-methoxy-2,5-dimethylphenyl)-N,2,2-trimethylpropanamide
CID 115154573
2-(4,5-dimethoxy-N,2-dimethylanilino)-2-methylpropanenitrile
CID 115129166
1-cyano-N-methyl-N-(2,4,5-trimethoxyphenyl)formamide
CID 115172074
2,2,2-trifluoro-N-(2-methoxy-5-methylphenyl)-N-methylacetamide
CID 115190160
2-methoxy-N,N,4,5-tetramethylaniline
CID 117043608
2-cyano-N-[(2,4-dimethoxyphenyl)methyl]-N,2-dimethylpropanamide
CID 47230621

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide?
The IUPAC name of 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide (CID 115175020) is 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide.
What is the SMILES notation for 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide?
The canonical SMILES for 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide is COc1cc(C)c(C)cc1N(C)C(=O)C(C)(C)C#N.
What is the InChIKey of 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide?
The InChIKey is CYMGSBYPBPOMIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10-7-12(13(19-6)8-11(10)2)17(5)14(18)15(3,4)9-16/h7-8H,1-6H3.
What are the key properties of 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide?
2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide has a molecular weight of 260.34 g/mol, XLogP of 2.82, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-(2-methoxy-4,5-dimethylphenyl)-N,2-dimethylpropanamide is sourced from PubChem (CID 115175020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).