N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide

C28H24N2O4 — CID 26522423

IUPACN-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide
SMILESCOc1ccccc1NC(=O)c1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C28H24N2O4/c1-33-26-13-6-5-12-25(26)30-27(31)21-14-16-23(17-15-21)29-28(32)22-10-7-11-24(18-22)34-19-20-8-3-2-4-9-20/h2-18H,19H2,1H3,(H,29,32)(H,30,31)
InChIKeyPRWKGNAUGFQDCB-UHFFFAOYSA-N
MW452.51 g/mol
LogP5.78
Rot. Bonds8

About N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide

N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide (PubChem CID 26522423) has the molecular formula C28H24N2O4 and a molecular weight of 452.51 g/mol. Its IUPAC name is N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide.

Molecular Properties

Compound NameN-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide
PubChem CID26522423
Molecular FormulaC28H24N2O4
Molecular Weight452.51 g/mol
Exact Mass452.17
IUPAC NameN-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide
SMILESCOc1ccccc1NC(=O)c1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1
InChIInChI=1S/C28H24N2O4/c1-33-26-13-6-5-12-25(26)30-27(31)21-14-16-23(17-15-21)29-28(32)22-10-7-11-24(18-22)34-19-20-8-3-2-4-9-20/h2-18H,19H2,1H3,(H,29,32)(H,30,31)
InChIKeyPRWKGNAUGFQDCB-UHFFFAOYSA-N
XLogP5.78
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.51
LogP ≤ 55.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
N-[2-methoxy-4-[(3-phenylmethoxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 5348268
3-ethoxy-N-(2-phenylmethoxyphenyl)benzamide
CID 17093571
N-[2-methoxy-4-[(3-phenylmethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide
CID 17111332
N-[4-(dimethylamino)phenyl]-3-phenylmethoxybenzamide
CID 23733067
N-(2-ethylphenyl)-3-phenylmethoxybenzamide
CID 801132
3-ethoxy-N-(2-methoxyphenyl)-4-phenylmethoxybenzamide
CID 126087524
N-(4-benzoylphenyl)-3-methoxy-4-phenylmethoxybenzamide
CID 139779423
N-[6-(dimethylamino)-3-pyridinyl]-3-phenylmethoxybenzamide
CID 30271698
N-[4-(2-methylpropoxy)phenyl]-3-phenylmethoxybenzamide
CID 17148534
3-phenylmethoxy-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
CID 33498503
3-methoxy-N-phenyl-4-phenylmethoxybenzamide
CID 5161412

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide?
The IUPAC name of N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide (CID 26522423) is N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide.
What is the SMILES notation for N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide?
The canonical SMILES for N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide is COc1ccccc1NC(=O)c1ccc(NC(=O)c2cccc(OCc3ccccc3)c2)cc1.
What is the InChIKey of N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide?
The InChIKey is PRWKGNAUGFQDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H24N2O4/c1-33-26-13-6-5-12-25(26)30-27(31)21-14-16-23(17-15-21)29-28(32)22-10-7-11-24(18-22)34-19-20-8-3-2-4-9-20/h2-18H,19H2,1H3,(H,29,32)(H,30,31).
What are the key properties of N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide?
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide has a molecular weight of 452.51 g/mol, XLogP of 5.78, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-phenylmethoxybenzamide is sourced from PubChem (CID 26522423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).