3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide

C21H19N3O3 — CID 18153307

IUPAC3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide
SMILESCOc1cccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1
InChIInChI=1S/C21H19N3O3/c1-27-19-12-5-7-15(13-19)20(25)22-17-10-6-11-18(14-17)24-21(26)23-16-8-3-2-4-9-16/h2-14H,1H3,(H,22,25)(H2,23,24,26)
InChIKeyUYCFCBYXGRLSSZ-UHFFFAOYSA-N
MW361.40 g/mol
LogP4.59
Rot. Bonds5

About 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide

3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide (PubChem CID 18153307) has the molecular formula C21H19N3O3 and a molecular weight of 361.40 g/mol. Its IUPAC name is 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide.

Molecular Properties

Compound Name3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide
PubChem CID18153307
Molecular FormulaC21H19N3O3
Molecular Weight361.40 g/mol
Exact Mass361.14
IUPAC Name3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide
SMILESCOc1cccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1
InChIInChI=1S/C21H19N3O3/c1-27-19-12-5-7-15(13-19)20(25)22-17-10-6-11-18(14-17)24-21(26)23-16-8-3-2-4-9-16/h2-14H,1H3,(H,22,25)(H2,23,24,26)
InChIKeyUYCFCBYXGRLSSZ-UHFFFAOYSA-N
XLogP4.59
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.40
LogP ≤ 54.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-N-(3-phenylphenyl)benzamide
CID 798645
3-N-(3-methoxyphenyl)-1-N-(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057620
3-methoxy-N-[4-(N-methylanilino)phenyl]benzamide
CID 112986095
4-[[3-[(3-methoxybenzoyl)amino]benzoyl]amino]benzoate
CID 4077385
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
1-N-(4-fluorophenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057463
2-[(3-methoxybenzoyl)amino]-N-(3-methoxyphenyl)benzamide
CID 51154923
N-(4-aminophenyl)-3-methoxybenzamide
CID 8566724
1-N-(3-acetylphenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057624
4-[(3-methoxyphenyl)carbamoylamino]benzoic acid
CID 4286151
N-(3-cyanophenyl)-3-methoxybenzamide
CID 2707607
N-(3-ethylphenyl)-3-methoxybenzamide
CID 896052

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide?
The IUPAC name of 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide (CID 18153307) is 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide.
What is the SMILES notation for 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide?
The canonical SMILES for 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide is COc1cccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1.
What is the InChIKey of 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide?
The InChIKey is UYCFCBYXGRLSSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3/c1-27-19-12-5-7-15(13-19)20(25)22-17-10-6-11-18(14-17)24-21(26)23-16-8-3-2-4-9-16/h2-14H,1H3,(H,22,25)(H2,23,24,26).
What are the key properties of 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide?
3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide has a molecular weight of 361.40 g/mol, XLogP of 4.59, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide is sourced from PubChem (CID 18153307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).