3-benzamido-N,N-dibutylbenzamide

C22H28N2O2 — CID 4270775

IUPAC3-benzamido-N,N-dibutylbenzamide
SMILESCCCCN(CCCC)C(=O)c1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C22H28N2O2/c1-3-5-15-24(16-6-4-2)22(26)19-13-10-14-20(17-19)23-21(25)18-11-8-7-9-12-18/h7-14,17H,3-6,15-16H2,1-2H3,(H,23,25)
InChIKeyHHBHCOYNBSNADP-UHFFFAOYSA-N
MW352.48 g/mol
LogP4.98
Rot. Bonds9

About 3-benzamido-N,N-dibutylbenzamide

3-benzamido-N,N-dibutylbenzamide (PubChem CID 4270775) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 3-benzamido-N,N-dibutylbenzamide.

Molecular Properties

Compound Name3-benzamido-N,N-dibutylbenzamide
PubChem CID4270775
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC Name3-benzamido-N,N-dibutylbenzamide
SMILESCCCCN(CCCC)C(=O)c1cccc(NC(=O)c2ccccc2)c1
InChIInChI=1S/C22H28N2O2/c1-3-5-15-24(16-6-4-2)22(26)19-13-10-14-20(17-19)23-21(25)18-11-8-7-9-12-18/h7-14,17H,3-6,15-16H2,1-2H3,(H,23,25)
InChIKeyHHBHCOYNBSNADP-UHFFFAOYSA-N
XLogP4.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-benzamido-N,N-dibutylbenzamide 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-[3-[butyl(2-hydroxyethyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 78862411
3-[(4-methoxybenzoyl)amino]-N,N-dipropylbenzamide
CID 26162261
methyl 3-[[3-(dipropylcarbamoyl)benzoyl]amino]benzoate
CID 109056644
N-[3-(dipropylcarbamoyl)phenyl]-2-fluorobenzamide
CID 26162428
2-bromo-N-[3-(dipropylcarbamoyl)phenyl]benzamide
CID 26162225
1-N-(3-fluorophenyl)-3-N,3-N-dipropylbenzene-1,3-dicarboxamide
CID 109056649
3-[(4-butan-2-yloxybenzoyl)amino]-N,N-dipropylbenzamide
CID 43877291
3-[[3-(2-phenylethoxy)benzoyl]amino]-N,N-dipropylbenzamide
CID 26162531
1-N-(3-fluorophenyl)-4-N,4-N-dipropylbenzene-1,4-dicarboxamide
CID 109049096
N-butyl-N-phenyl-3-(propanoylamino)benzamide
CID 17309767
3-benzamido-N-benzyl-N-methylbenzamide
CID 3936845
N-[3-(diethylcarbamoyl)phenyl]-3-methylbenzamide
CID 17194507

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N,N-dibutylbenzamide?
The IUPAC name of 3-benzamido-N,N-dibutylbenzamide (CID 4270775) is 3-benzamido-N,N-dibutylbenzamide.
What is the SMILES notation for 3-benzamido-N,N-dibutylbenzamide?
The canonical SMILES for 3-benzamido-N,N-dibutylbenzamide is CCCCN(CCCC)C(=O)c1cccc(NC(=O)c2ccccc2)c1.
What is the InChIKey of 3-benzamido-N,N-dibutylbenzamide?
The InChIKey is HHBHCOYNBSNADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c1-3-5-15-24(16-6-4-2)22(26)19-13-10-14-20(17-19)23-21(25)18-11-8-7-9-12-18/h7-14,17H,3-6,15-16H2,1-2H3,(H,23,25).
What are the key properties of 3-benzamido-N,N-dibutylbenzamide?
3-benzamido-N,N-dibutylbenzamide has a molecular weight of 352.48 g/mol, XLogP of 4.98, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N,N-dibutylbenzamide is sourced from PubChem (CID 4270775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).