N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide

C18H20N2O3 — CID 17045479

IUPACN-(4-acetamidophenyl)-2-propan-2-yloxybenzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccccc2OC(C)C)cc1
InChIInChI=1S/C18H20N2O3/c1-12(2)23-17-7-5-4-6-16(17)18(22)20-15-10-8-14(9-11-15)19-13(3)21/h4-12H,1-3H3,(H,19,21)(H,20,22)
InChIKeyRBJQWSOYUMVIEJ-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.68
Rot. Bonds5

About N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide

N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide (PubChem CID 17045479) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-propan-2-yloxybenzamide
PubChem CID17045479
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-(4-acetamidophenyl)-2-propan-2-yloxybenzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2ccccc2OC(C)C)cc1
InChIInChI=1S/C18H20N2O3/c1-12(2)23-17-7-5-4-6-16(17)18(22)20-15-10-8-14(9-11-15)19-13(3)21/h4-12H,1-3H3,(H,19,21)(H,20,22)
InChIKeyRBJQWSOYUMVIEJ-UHFFFAOYSA-N
XLogP3.68
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-propan-2-yloxy-N-[4-[(2-propan-2-yloxybenzoyl)amino]phenyl]benzamide
CID 17046033
N-[4-(methylcarbamoyl)phenyl]-2-propan-2-yloxybenzamide
CID 28642699
N-(4-butoxyphenyl)-2-propan-2-yloxybenzamide
CID 17045605
ethyl 4-[(2-propan-2-yloxybenzoyl)amino]benzoate
CID 17045515
N-(3-chloro-4-methylphenyl)-2-propan-2-yloxybenzamide
CID 17045551
N-[4-(4-methylpiperazin-1-yl)phenyl]-2-propan-2-yloxybenzamide
CID 50946132
N-propan-2-yl-2-[(2-propan-2-yloxybenzoyl)amino]benzamide
CID 17045597
N-[3-(propan-2-ylcarbamoyl)phenyl]-2-propan-2-yloxybenzamide
CID 17197512
2-[(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl]oxy-N-phenylbenzamide
CID 7980882
2-[(2R)-1-(4-ethylanilino)-1-oxopropan-2-yl]oxy-N-phenylbenzamide
CID 7980806
N-[(2R)-3-methylbutan-2-yl]-2-propan-2-yloxybenzamide
CID 100570232
2-[1-(4-acetamidoanilino)-1-oxopropan-2-yl]oxy-N-benzylbenzamide
CID 4285450

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide?
The IUPAC name of N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide (CID 17045479) is N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide is CC(=O)Nc1ccc(NC(=O)c2ccccc2OC(C)C)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide?
The InChIKey is RBJQWSOYUMVIEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-12(2)23-17-7-5-4-6-16(17)18(22)20-15-10-8-14(9-11-15)19-13(3)21/h4-12H,1-3H3,(H,19,21)(H,20,22).
What are the key properties of N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide?
N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide has a molecular weight of 312.37 g/mol, XLogP of 3.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-propan-2-yloxybenzamide is sourced from PubChem (CID 17045479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).