methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate

C16H15NO4 — CID 7733773

IUPACmethyl 4-[(4-methoxyphenyl)carbamoyl]benzoate
SMILESCOC(=O)c1ccc(C(=O)Nc2ccc(OC)cc2)cc1
InChIInChI=1S/C16H15NO4/c1-20-14-9-7-13(8-10-14)17-15(18)11-3-5-12(6-4-11)16(19)21-2/h3-10H,1-2H3,(H,17,18)
InChIKeyQOXJZHRWZFRQGX-UHFFFAOYSA-N
MW285.30 g/mol
LogP2.73
Rot. Bonds4

About methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate

methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate (PubChem CID 7733773) has the molecular formula C16H15NO4 and a molecular weight of 285.30 g/mol. Its IUPAC name is methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate.

Molecular Properties

Compound Namemethyl 4-[(4-methoxyphenyl)carbamoyl]benzoate
PubChem CID7733773
Molecular FormulaC16H15NO4
Molecular Weight285.30 g/mol
Exact Mass285.10
IUPAC Namemethyl 4-[(4-methoxyphenyl)carbamoyl]benzoate
SMILESCOC(=O)c1ccc(C(=O)Nc2ccc(OC)cc2)cc1
InChIInChI=1S/C16H15NO4/c1-20-14-9-7-13(8-10-14)17-15(18)11-3-5-12(6-4-11)16(19)21-2/h3-10H,1-2H3,(H,17,18)
InChIKeyQOXJZHRWZFRQGX-UHFFFAOYSA-N
XLogP2.73
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxyphenyl)-1-methylpyridin-1-ium-4-carboxamide
CID 1110822
N-(4-bromophenyl)-4-[(4-methoxybenzoyl)amino]benzamide
CID 2214535
4-hydrazinyl-N-(4-methoxyphenyl)benzamide
CID 62237684
methyl 4-[[4-[(4-hydroxyphenyl)carbamoyl]phenyl]carbamoyl]benzoate
CID 3353390
4-methoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 2678249
methyl 4-[[4-(2-methoxyethoxy)phenyl]carbamoyl]benzoate
CID 17178280
N-[4-(4-acetamidoanilino)phenyl]-4-methoxybenzamide
CID 112988363
methyl 4-[(4-carbamoylphenyl)carbamoyl]benzoate
CID 5085217
methyl 4-[(4-carbamoylbenzoyl)amino]benzoate
CID 30845691
2-methylpropyl 4-[(4-methoxybenzoyl)amino]benzoate
CID 732519
N-(4-methoxyphenyl)-4-(4-methylphenoxy)benzamide
CID 16651033
4-N-tert-butyl-1-N-(4-methoxyphenyl)benzene-1,4-dicarboxamide
CID 48845743

Frequently Asked Questions

What is the IUPAC name of methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate?
The IUPAC name of methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate (CID 7733773) is methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate.
What is the SMILES notation for methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate?
The canonical SMILES for methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate is COC(=O)c1ccc(C(=O)Nc2ccc(OC)cc2)cc1.
What is the InChIKey of methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate?
The InChIKey is QOXJZHRWZFRQGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO4/c1-20-14-9-7-13(8-10-14)17-15(18)11-3-5-12(6-4-11)16(19)21-2/h3-10H,1-2H3,(H,17,18).
What are the key properties of methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate?
methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate has a molecular weight of 285.30 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate is sourced from PubChem (CID 7733773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).