2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide

C16H17N3O3 — CID 58730700

IUPAC2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide
SMILESCNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1OC
InChIInChI=1S/C16H17N3O3/c1-17-15(20)13-9-8-12(10-14(13)22-2)19-16(21)18-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,20)(H2,18,19,21)
InChIKeyCEBDBPJISGQFBE-UHFFFAOYSA-N
MW299.33 g/mol
LogP2.70
Rot. Bonds4

About 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide

2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide (PubChem CID 58730700) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide.

Molecular Properties

Compound Name2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide
PubChem CID58730700
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide
SMILESCNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1OC
InChIInChI=1S/C16H17N3O3/c1-17-15(20)13-9-8-12(10-14(13)22-2)19-16(21)18-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,20)(H2,18,19,21)
InChIKeyCEBDBPJISGQFBE-UHFFFAOYSA-N
XLogP2.70
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 52.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methylcarbamoyl)-5-(phenylcarbamoylamino)benzenesulfonic acid
CID 173100746
[3-methoxy-4-(phenylcarbamoyl)phenyl]boronic acid
CID 22346905
1-(4-anilino-2-methoxyphenyl)-3-phenylurea
CID 110179401
N'-(3,4-dimethoxyphenyl)-N-phenyloxamide
CID 44999686
4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide
CID 17180805
3,4,5-trimethoxy-N-[[3-[(4-phenylphenyl)carbamoylamino]phenyl]carbamoyl]benzamide
CID 58506935
1-(3-methoxy-4-phenoxyphenyl)-3-(3-methoxyphenyl)urea
CID 139434076
1-[6-(3,4-dimethoxyanilino)-3-pyridinyl]-3-phenylurea
CID 113020117
methyl 2-(4-methoxyphenyl)sulfonyloxy-4-(phenylcarbamoylamino)benzoate
CID 168860625
1-(4-anilino-2-methoxyphenyl)-3-methylurea
CID 110178450
2-methoxy-4-(1H-pyrazol-4-ylcarbamoylamino)benzoic acid
CID 107209397
N-(4-acetyl-3-methoxyphenyl)acetamide
CID 13221159

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide?
The IUPAC name of 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide (CID 58730700) is 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide.
What is the SMILES notation for 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide?
The canonical SMILES for 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide is CNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1OC.
What is the InChIKey of 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide?
The InChIKey is CEBDBPJISGQFBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-17-15(20)13-9-8-12(10-14(13)22-2)19-16(21)18-11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,20)(H2,18,19,21).
What are the key properties of 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide?
2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide has a molecular weight of 299.33 g/mol, XLogP of 2.70, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-4-(phenylcarbamoylamino)benzamide is sourced from PubChem (CID 58730700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).