3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide

C20H22N2O3 — CID 154847774

IUPAC3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)NC2(c3ccccc3)CCOC2)c1C
InChIInChI=1S/C20H22N2O3/c1-14-17(9-6-10-18(14)21-15(2)23)19(24)22-20(11-12-25-13-20)16-7-4-3-5-8-16/h3-10H,11-13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyUHYHZPSSZTUMEF-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.00
Rot. Bonds4

About 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide

3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide (PubChem CID 154847774) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide.

Molecular Properties

Compound Name3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide
PubChem CID154847774
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)NC2(c3ccccc3)CCOC2)c1C
InChIInChI=1S/C20H22N2O3/c1-14-17(9-6-10-18(14)21-15(2)23)19(24)22-20(11-12-25-13-20)16-7-4-3-5-8-16/h3-10H,11-13H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyUHYHZPSSZTUMEF-UHFFFAOYSA-N
XLogP3.00
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Ethyl 3-[(2-methylbenzoyl)amino]benzoate
CID 835414
N-(2,3-dimethylphenyl)-2-(2-methoxyethyl)-3-oxoisoindoline-4-carboxamide
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3-amino-N-(2,3-dimethylphenyl)benzamide
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2-[(2,3-Dimethylphenyl)amino]-2-oxoethyl 3-phenylpropanoate
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[(3-Acetylphenyl)carbamoyl]methyl 2-phenylbutanoate
CID 4157667
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CID 49788033
N-[3-(4-chlorophenyl)oxetan-3-yl]-2-oxo-1,3-dihydroindole-4-carboxamide
CID 166401798
N-[4-[2-oxo-2-[(3-phenyloxetan-3-yl)amino]ethyl]phenyl]prop-2-enamide
CID 166421379
N-(2,3-dimethylphenyl)-4-(morpholin-4-ylmethyl)benzamide
CID 674230
N-(2,3-dimethylphenyl)-3-(2,2-dimethylpropanoylamino)benzamide
CID 777094
3-amino-N-[3-(oxan-4-yl)phenyl]benzamide
CID 132349024
3,3-dimethyl-2-oxo-N-(3-phenyloxetan-3-yl)-1H-indole-5-carboxamide
CID 138021757

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide?
The IUPAC name of 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide (CID 154847774) is 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide.
What is the SMILES notation for 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide?
The canonical SMILES for 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide is CC(=O)Nc1cccc(C(=O)NC2(c3ccccc3)CCOC2)c1C.
What is the InChIKey of 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide?
The InChIKey is UHYHZPSSZTUMEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-14-17(9-6-10-18(14)21-15(2)23)19(24)22-20(11-12-25-13-20)16-7-4-3-5-8-16/h3-10H,11-13H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide?
3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide has a molecular weight of 338.41 g/mol, XLogP of 3.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-2-methyl-N-(3-phenyloxolan-3-yl)benzamide is sourced from PubChem (CID 154847774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).