3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide

C22H26N2O2 — CID 55632308

IUPAC3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide
SMILESCCN(C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1)C1CCCC1
InChIInChI=1S/C22H26N2O2/c1-3-24(19-11-7-8-12-19)22(26)18-14-13-16(2)20(15-18)23-21(25)17-9-5-4-6-10-17/h4-6,9-10,13-15,19H,3,7-8,11-12H2,1-2H3,(H,23,25)
InChIKeyHEQVVNQHNBBSGF-UHFFFAOYSA-N
MW350.46 g/mol
LogP4.65
Rot. Bonds5

About 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide

3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide (PubChem CID 55632308) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide.

Molecular Properties

Compound Name3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide
PubChem CID55632308
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide
SMILESCCN(C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1)C1CCCC1
InChIInChI=1S/C22H26N2O2/c1-3-24(19-11-7-8-12-19)22(26)18-14-13-16(2)20(15-18)23-21(25)17-9-5-4-6-10-17/h4-6,9-10,13-15,19H,3,7-8,11-12H2,1-2H3,(H,23,25)
InChIKeyHEQVVNQHNBBSGF-UHFFFAOYSA-N
XLogP4.65
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-benzamido-4-methyl-N,N-dipropylbenzamide
CID 17226384
N-cyclopentyl-N-ethyl-4-hydroxy-3-methylbenzamide
CID 103951919
3-benzamido-N,4-dimethyl-N-[(4-methylphenyl)methyl]benzamide
CID 46409799
3-benzamido-N-[4-(cyclohexylcarbamoyl)-2-methylphenyl]-4-methylbenzamide
CID 55878666
N-cyclopentyl-N-ethyl-3-methoxy-4-methylbenzamide
CID 134060958
N-[2-(aminomethyl)cyclopentyl]-3-benzamido-4-methylbenzamide
CID 119603863
3-benzamido-4-methyl-N-pentylbenzamide
CID 17226355
3-benzamido-4-methyl-N-[4-(propanoylamino)phenyl]benzamide
CID 55788298
3-benzamido-N,4-dimethylbenzamide
CID 17226324
3-benzamido-N-[(4-bromophenyl)methyl]-N,4-dimethylbenzamide
CID 55630306
N-[5-[cyclohexyl(propanoyl)amino]-2-methylphenyl]-4-hydroxybenzamide
CID 57251136
3-benzamido-N-(cyanomethyl)-4-methyl-N-propylbenzamide
CID 52729740

Frequently Asked Questions

What is the IUPAC name of 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide?
The IUPAC name of 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide (CID 55632308) is 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide.
What is the SMILES notation for 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide?
The canonical SMILES for 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide is CCN(C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1)C1CCCC1.
What is the InChIKey of 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide?
The InChIKey is HEQVVNQHNBBSGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-3-24(19-11-7-8-12-19)22(26)18-14-13-16(2)20(15-18)23-21(25)17-9-5-4-6-10-17/h4-6,9-10,13-15,19H,3,7-8,11-12H2,1-2H3,(H,23,25).
What are the key properties of 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide?
3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide has a molecular weight of 350.46 g/mol, XLogP of 4.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzamido-N-cyclopentyl-N-ethyl-4-methylbenzamide is sourced from PubChem (CID 55632308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).