N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide

C21H24N2O4 — CID 113095202

IUPACN-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide
SMILESCOc1ccccc1C(=O)N(c1ccc(NC(C)=O)cc1)C1CCOCC1
InChIInChI=1S/C21H24N2O4/c1-15(24)22-16-7-9-17(10-8-16)23(18-11-13-27-14-12-18)21(25)19-5-3-4-6-20(19)26-2/h3-10,18H,11-14H2,1-2H3,(H,22,24)
InChIKeyHWEAALMRHQLYJP-UHFFFAOYSA-N
MW368.43 g/mol
LogP3.48
Rot. Bonds5

About N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide

N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide (PubChem CID 113095202) has the molecular formula C21H24N2O4 and a molecular weight of 368.43 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide
PubChem CID113095202
Molecular FormulaC21H24N2O4
Molecular Weight368.43 g/mol
Exact Mass368.17
IUPAC NameN-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide
SMILESCOc1ccccc1C(=O)N(c1ccc(NC(C)=O)cc1)C1CCOCC1
InChIInChI=1S/C21H24N2O4/c1-15(24)22-16-7-9-17(10-8-16)23(18-11-13-27-14-12-18)21(25)19-5-3-4-6-20(19)26-2/h3-10,18H,11-14H2,1-2H3,(H,22,24)
InChIKeyHWEAALMRHQLYJP-UHFFFAOYSA-N
XLogP3.48
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[oxan-4-yl(phenylcarbamoyl)amino]phenyl]acetamide
CID 113095234
N-(oxan-4-yl)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 113094206
N-[4-[acetyl(oxan-4-yl)amino]phenyl]-4-methoxybenzamide
CID 113094176
N-[4-[oxan-4-yl(propan-2-ylcarbamoyl)amino]phenyl]acetamide
CID 113095241
N-[4-[acetyl(oxan-4-yl)amino]phenyl]-4-methylbenzamide
CID 113094170
methyl N-(4-acetamidophenyl)-N-cyclopropylcarbamate
CID 113095123
N-[4-(cyclopropylcarbamoylamino)phenyl]-N-(oxan-4-yl)acetamide
CID 113094214
N-[4-[acetyl(oxan-4-yl)amino]phenyl]butanamide
CID 113094156
N-(4-fluorophenyl)-2-methoxy-N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]benzamide
CID 46048053
N-(4-acetamidophenyl)-2-(3-methylphenyl)-N-(oxan-4-yl)acetamide
CID 113095232
N-[4-[methylsulfonyl(oxan-4-yl)amino]phenyl]acetamide
CID 113094432
N-[4-(benzenesulfonamido)phenyl]-N-(oxan-4-yl)acetamide
CID 113094220

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide?
The IUPAC name of N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide (CID 113095202) is N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide is COc1ccccc1C(=O)N(c1ccc(NC(C)=O)cc1)C1CCOCC1.
What is the InChIKey of N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide?
The InChIKey is HWEAALMRHQLYJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O4/c1-15(24)22-16-7-9-17(10-8-16)23(18-11-13-27-14-12-18)21(25)19-5-3-4-6-20(19)26-2/h3-10,18H,11-14H2,1-2H3,(H,22,24).
What are the key properties of N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide?
N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide has a molecular weight of 368.43 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-methoxy-N-(oxan-4-yl)benzamide is sourced from PubChem (CID 113095202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).