2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide

C15H22N2O — CID 79979065

IUPAC2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide
SMILESCC(NCc1ccc(C2CC2)cc1)C(=O)N(C)C
InChIInChI=1S/C15H22N2O/c1-11(15(18)17(2)3)16-10-12-4-6-13(7-5-12)14-8-9-14/h4-7,11,14,16H,8-10H2,1-3H3
InChIKeyCTKSDQRGRWISSH-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.13
Rot. Bonds5

About 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide

2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide (PubChem CID 79979065) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide
PubChem CID79979065
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide
SMILESCC(NCc1ccc(C2CC2)cc1)C(=O)N(C)C
InChIInChI=1S/C15H22N2O/c1-11(15(18)17(2)3)16-10-12-4-6-13(7-5-12)14-8-9-14/h4-7,11,14,16H,8-10H2,1-3H3
InChIKeyCTKSDQRGRWISSH-UHFFFAOYSA-N
XLogP2.13
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(4-cyclopropylphenyl)methylamino]-N,N-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

N,N-dimethyl-2-[(4-pyrrolidin-1-ylphenyl)methylamino]propanamide
CID 43778128
N,N-dimethyl-2-[(4-propoxyphenyl)methylamino]propanamide
CID 43573853
N-[(4-cyclopropylphenyl)methyl]propan-2-amine
CID 62491335
2-(aminomethyl)-3-(4-cyclopropylphenyl)-N,N-dimethylpropanamide
CID 79980218
N,N-dimethyl-2-[[4-(3-methylbutoxy)phenyl]methylamino]propanamide
CID 43573860
N,N-dimethyl-2-[(4-prop-2-enoxyphenyl)methylamino]propanamide
CID 43573850
2-[(3,5-dimethylphenyl)methylamino]-N,N-dimethylpropanamide
CID 54983664
2-[(3-fluoro-4-hydroxyphenyl)methylamino]-N,N-dimethylpropanamide
CID 107685376
2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethylamino)-N,N-dimethylpropanamide
CID 60871279
(2R)-2-[(4-cyclopropylphenyl)methylamino]propan-1-ol
CID 114985652
2-[(4-hydroxy-3-methoxyphenyl)methylamino]-N,N-dimethylpropanamide
CID 43573898
2-[(4-methoxy-3-methylphenyl)methylamino]-N,N-dimethylpropanamide
CID 43778166

Frequently Asked Questions

What is the IUPAC name of 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide (CID 79979065) is 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide is CC(NCc1ccc(C2CC2)cc1)C(=O)N(C)C.
What is the InChIKey of 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide?
The InChIKey is CTKSDQRGRWISSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11(15(18)17(2)3)16-10-12-4-6-13(7-5-12)14-8-9-14/h4-7,11,14,16H,8-10H2,1-3H3.
What are the key properties of 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide?
2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide has a molecular weight of 246.35 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-cyclopropylphenyl)methylamino]-N,N-dimethylpropanamide is sourced from PubChem (CID 79979065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).