2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide

C20H22N2O3 — CID 7378718

IUPAC2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
SMILESCc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)c1
InChIInChI=1S/C20H22N2O3/c1-14-6-4-7-15(12-14)19(23)22-18-10-3-2-9-17(18)20(24)21-13-16-8-5-11-25-16/h2-4,6-7,9-10,12,16H,5,8,11,13H2,1H3,(H,21,24)(H,22,23)/t16-/m0/s1
InChIKeySIDWJGJHLSPDSJ-INIZCTEOSA-N
MW338.41 g/mol
LogP3.16
Rot. Bonds5

About 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide

2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide (PubChem CID 7378718) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide.

Molecular Properties

Compound Name2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
PubChem CID7378718
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide
SMILESCc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)c1
InChIInChI=1S/C20H22N2O3/c1-14-6-4-7-15(12-14)19(23)22-18-10-3-2-9-17(18)20(24)21-13-16-8-5-11-25-16/h2-4,6-7,9-10,12,16H,5,8,11,13H2,1H3,(H,21,24)(H,22,23)/t16-/m0/s1
InChIKeySIDWJGJHLSPDSJ-INIZCTEOSA-N
XLogP3.16
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-benzamido-4-methyl-N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 17226585
2-[(3-benzamidobenzoyl)amino]-N-(oxolan-2-ylmethyl)benzamide
CID 17321274
2-[[3-(methylsulfamoyl)benzoyl]amino]-N-(oxolan-2-ylmethyl)benzamide
CID 133231300
3-methyl-N-[3-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 17362725
N-[[(2R)-oxolan-2-yl]methyl]-2-[[3-(2-phenoxyethoxy)benzoyl]amino]benzamide
CID 42427228
3-methyl-N-[4-(oxolan-2-ylmethylcarbamoyl)phenyl]benzamide
CID 17205629
N-(oxolan-2-ylmethyl)-2-[[3-(propan-2-ylsulfamoyl)benzoyl]amino]benzamide
CID 43040270
2-[[3-(2-ethylbutanoylamino)benzoyl]amino]-N-(oxolan-2-ylmethyl)benzamide
CID 17321471
2-[[2-(2,4-dimethylphenyl)acetyl]amino]-N-(oxolan-2-ylmethyl)benzamide
CID 133200000
2-[(4-fluorobenzoyl)amino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 7378690
N-[2-(oxolan-2-ylmethylcarbamoyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 46542044
N-[2-[[(2R)-oxolan-2-yl]methylcarbamoyl]phenyl]naphthalene-1-carboxamide
CID 1319633

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide?
The IUPAC name of 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide (CID 7378718) is 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide.
What is the SMILES notation for 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide?
The canonical SMILES for 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide is Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@H]2CCCO2)c1.
What is the InChIKey of 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide?
The InChIKey is SIDWJGJHLSPDSJ-INIZCTEOSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-14-6-4-7-15(12-14)19(23)22-18-10-3-2-9-17(18)20(24)21-13-16-8-5-11-25-16/h2-4,6-7,9-10,12,16H,5,8,11,13H2,1H3,(H,21,24)(H,22,23)/t16-/m0/s1.
What are the key properties of 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide?
2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide has a molecular weight of 338.41 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methylbenzoyl)amino]-N-[[(2S)-oxolan-2-yl]methyl]benzamide is sourced from PubChem (CID 7378718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).