N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide

C14H19N3O — CID 62982145

IUPACN-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide
SMILESCCNC(C)(C)C(=O)N(C)c1ccc(C#N)cc1
InChIInChI=1S/C14H19N3O/c1-5-16-14(2,3)13(18)17(4)12-8-6-11(10-15)7-9-12/h6-9,16H,5H2,1-4H3
InChIKeyYBBSXNANDPBXKY-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.91
Rot. Bonds4

About N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide

N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide (PubChem CID 62982145) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide
PubChem CID62982145
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide
SMILESCCNC(C)(C)C(=O)N(C)c1ccc(C#N)cc1
InChIInChI=1S/C14H19N3O/c1-5-16-14(2,3)13(18)17(4)12-8-6-11(10-15)7-9-12/h6-9,16H,5H2,1-4H3
InChIKeyYBBSXNANDPBXKY-UHFFFAOYSA-N
XLogP1.91
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-cyanophenyl)-2-(ethylamino)-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

N-(4-cyanophenyl)-2-hydroxy-N,2-dimethylpropanamide
CID 103429961
2-amino-N-(4-cyanophenyl)-N,2-dimethylbutanamide
CID 79811112
2-amino-N-(4-cyanophenyl)-N,2-dimethylpropanamide
CID 62983360
N-(4-cyanophenyl)-2-methoxy-N,2-dimethylbutanamide
CID 114105638
N-[4-[3-(4-cyanophenoxy)propoxy]phenyl]-N,2,2-trimethylpropanamide
CID 112827984
1-(4-cyanophenyl)-3,3-diethyl-1-methylurea
CID 79161464
2-bromo-N-(4-cyanophenyl)-N-methylacetamide
CID 63679745
3-[[(4-cyanophenyl)-methylcarbamoyl]amino]-2-hydroxy-2-methylpropanoic acid
CID 66175112
N-(4-cyanophenyl)-N',2,2-trimethyl-N'-phenylpropanediamide
CID 108967624
N-(4-cyanophenyl)-5-(ethylamino)-N-methyl-1,3,4-thiadiazole-2-carboxamide
CID 80616254
N-ethyl-2-(ethylamino)-N-(4-fluorophenyl)-2-methylpropanamide
CID 55121871
2-cyano-N-(4-cyanophenyl)-N-methylbutanamide
CID 62981149

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide?
The IUPAC name of N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide (CID 62982145) is N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide?
The canonical SMILES for N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide is CCNC(C)(C)C(=O)N(C)c1ccc(C#N)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide?
The InChIKey is YBBSXNANDPBXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-5-16-14(2,3)13(18)17(4)12-8-6-11(10-15)7-9-12/h6-9,16H,5H2,1-4H3.
What are the key properties of N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide?
N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide has a molecular weight of 245.33 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-(ethylamino)-N,2-dimethylpropanamide is sourced from PubChem (CID 62982145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).