2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide

C12H15NO — CID 155942818

IUPAC2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide
SMILESCc1cc(C)cc(C2CC2C(N)=O)c1
InChIInChI=1S/C12H15NO/c1-7-3-8(2)5-9(4-7)10-6-11(10)12(13)14/h3-5,10-11H,6H2,1-2H3,(H2,13,14)
InChIKeyZMQWPLCCQWVQPK-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.89
Rot. Bonds2

About 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide

2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide (PubChem CID 155942818) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide
PubChem CID155942818
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide
SMILESCc1cc(C)cc(C2CC2C(N)=O)c1
InChIInChI=1S/C12H15NO/c1-7-3-8(2)5-9(4-7)10-6-11(10)12(13)14/h3-5,10-11H,6H2,1-2H3,(H2,13,14)
InChIKeyZMQWPLCCQWVQPK-UHFFFAOYSA-N
XLogP1.89
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide (CID 155942818) is 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide is Cc1cc(C)cc(C2CC2C(N)=O)c1.
What is the InChIKey of 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide?
The InChIKey is ZMQWPLCCQWVQPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-7-3-8(2)5-9(4-7)10-6-11(10)12(13)14/h3-5,10-11H,6H2,1-2H3,(H2,13,14).
What are the key properties of 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide?
2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide has a molecular weight of 189.26 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 155942818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).