4-[3-(ethylamino)butanoylamino]-N-methylbenzamide

C14H21N3O2 — CID 62837204

IUPAC4-[3-(ethylamino)butanoylamino]-N-methylbenzamide
SMILESCCNC(C)CC(=O)Nc1ccc(C(=O)NC)cc1
InChIInChI=1S/C14H21N3O2/c1-4-16-10(2)9-13(18)17-12-7-5-11(6-8-12)14(19)15-3/h5-8,10,16H,4,9H2,1-3H3,(H,15,19)(H,17,18)
InChIKeyPLILBCLOWLZZRR-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.37
Rot. Bonds6

About 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide

4-[3-(ethylamino)butanoylamino]-N-methylbenzamide (PubChem CID 62837204) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide.

Molecular Properties

Compound Name4-[3-(ethylamino)butanoylamino]-N-methylbenzamide
PubChem CID62837204
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name4-[3-(ethylamino)butanoylamino]-N-methylbenzamide
SMILESCCNC(C)CC(=O)Nc1ccc(C(=O)NC)cc1
InChIInChI=1S/C14H21N3O2/c1-4-16-10(2)9-13(18)17-12-7-5-11(6-8-12)14(19)15-3/h5-8,10,16H,4,9H2,1-3H3,(H,15,19)(H,17,18)
InChIKeyPLILBCLOWLZZRR-UHFFFAOYSA-N
XLogP1.37
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide 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-[3-(ethylamino)butanoylamino]-N-propan-2-ylbenzamide
CID 62838667
3-(ethylamino)-N-(4-propan-2-yloxyphenyl)butanamide
CID 62838247
3-[4-[3-(ethylamino)butanoylamino]phenyl]butanoic acid
CID 104503048
N-[4-[3-(ethylamino)butanoylamino]phenyl]cyclopropanecarboxamide
CID 62839619
N-(3-chloro-4-methylphenyl)-3-(ethylamino)butanamide
CID 60663237
(E)-3-[4-[3-(ethylamino)butanoylamino]phenyl]prop-2-enoic acid
CID 115342286
N-[4-(difluoromethylsulfonyl)phenyl]-3-(ethylamino)butanamide
CID 62837560
N-methyl-4-[(E)-3-[4-(3-methylbutanoylamino)anilino]-3-oxoprop-1-enyl]benzamide
CID 46556757
N-(4-bromo-3-methylphenyl)-3-(ethylamino)butanamide
CID 62838768
3-(ethylamino)-N-[4-[ethyl(2-hydroxyethyl)amino]phenyl]butanamide
CID 62837414
N-(3,5-dichlorophenyl)-3-(ethylamino)butanamide
CID 62839661
4-(3-aminobutanoylamino)-N-ethylbenzamide;hydrochloride
CID 119714141

Frequently Asked Questions

What is the IUPAC name of 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide?
The IUPAC name of 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide (CID 62837204) is 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide.
What is the SMILES notation for 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide?
The canonical SMILES for 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide is CCNC(C)CC(=O)Nc1ccc(C(=O)NC)cc1.
What is the InChIKey of 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide?
The InChIKey is PLILBCLOWLZZRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-4-16-10(2)9-13(18)17-12-7-5-11(6-8-12)14(19)15-3/h5-8,10,16H,4,9H2,1-3H3,(H,15,19)(H,17,18).
What are the key properties of 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide?
4-[3-(ethylamino)butanoylamino]-N-methylbenzamide has a molecular weight of 263.34 g/mol, XLogP of 1.37, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(ethylamino)butanoylamino]-N-methylbenzamide is sourced from PubChem (CID 62837204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).