N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide

C15H24N2O — CID 65042626

IUPACN-(3-ethylpentan-3-yl)-4-(methylamino)benzamide
SMILESCCC(CC)(CC)NC(=O)c1ccc(NC)cc1
InChIInChI=1S/C15H24N2O/c1-5-15(6-2,7-3)17-14(18)12-8-10-13(16-4)11-9-12/h8-11,16H,5-7H2,1-4H3,(H,17,18)
InChIKeyIBWVSYPJDKGUQC-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.43
Rot. Bonds6

About N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide

N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide (PubChem CID 65042626) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide.

Molecular Properties

Compound NameN-(3-ethylpentan-3-yl)-4-(methylamino)benzamide
PubChem CID65042626
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(3-ethylpentan-3-yl)-4-(methylamino)benzamide
SMILESCCC(CC)(CC)NC(=O)c1ccc(NC)cc1
InChIInChI=1S/C15H24N2O/c1-5-15(6-2,7-3)17-14(18)12-8-10-13(16-4)11-9-12/h8-11,16H,5-7H2,1-4H3,(H,17,18)
InChIKeyIBWVSYPJDKGUQC-UHFFFAOYSA-N
XLogP3.43
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide 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

4-(aminomethyl)-N-(3-ethylpentan-3-yl)benzamide;hydrochloride
CID 119334920
N-[3-(aminomethyl)pentan-3-yl]-4-fluorobenzamide;hydrochloride
CID 119570827
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-4-(trifluoromethyl)benzamide
CID 103602168
N-[3-(hydroxymethyl)pentan-3-yl]benzamide
CID 55209778
4-(3-aminoprop-1-ynyl)-N-(3-ethylpentan-3-yl)benzamide
CID 65043007
N-(3-ethylpentan-3-yl)-3,5-difluoro-4-(methylamino)benzamide
CID 65042721
4-bromo-N-[1-chloro-2-(chloromethyl)butan-2-yl]benzamide
CID 107867592
N-(2,2-dimethylpentyl)-4-(methylamino)benzamide
CID 115161129
3-bromo-N-(3-ethylpentan-3-yl)-4-fluorobenzamide
CID 113244906
4-amino-N-(3-ethylpentan-3-yl)-3-iodobenzamide
CID 112750872
4-butyl-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]benzamide
CID 104630211
3-amino-4-chloro-N-(3-ethylpentan-3-yl)benzamide
CID 65037878

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide?
The IUPAC name of N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide (CID 65042626) is N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide.
What is the SMILES notation for N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide?
The canonical SMILES for N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide is CCC(CC)(CC)NC(=O)c1ccc(NC)cc1.
What is the InChIKey of N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide?
The InChIKey is IBWVSYPJDKGUQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-5-15(6-2,7-3)17-14(18)12-8-10-13(16-4)11-9-12/h8-11,16H,5-7H2,1-4H3,(H,17,18).
What are the key properties of N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide?
N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide has a molecular weight of 248.37 g/mol, XLogP of 3.43, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylpentan-3-yl)-4-(methylamino)benzamide is sourced from PubChem (CID 65042626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).