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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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).