4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide

C16H17N3O3 — CID 17180805

IUPAC4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccc(NC(=O)Nc2cccc(OC)c2)cc1
InChIInChI=1S/C16H17N3O3/c1-17-15(20)11-6-8-12(9-7-11)18-16(21)19-13-4-3-5-14(10-13)22-2/h3-10H,1-2H3,(H,17,20)(H2,18,19,21)
InChIKeyNRMHISKVDMLWIY-UHFFFAOYSA-N
MW299.33 g/mol
LogP2.70
Rot. Bonds4

About 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide

4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide (PubChem CID 17180805) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide.

Molecular Properties

Compound Name4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide
PubChem CID17180805
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccc(NC(=O)Nc2cccc(OC)c2)cc1
InChIInChI=1S/C16H17N3O3/c1-17-15(20)11-6-8-12(9-7-11)18-16(21)19-13-4-3-5-14(10-13)22-2/h3-10H,1-2H3,(H,17,20)(H2,18,19,21)
InChIKeyNRMHISKVDMLWIY-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

4-[(3-methoxyphenyl)carbamoylamino]-N-propan-2-ylbenzamide
CID 17180581
4-[(3-methoxyphenyl)carbamoylamino]benzoic acid
CID 4286151
1-(3-methoxyphenyl)-3-(4-methoxyphenyl)urea
CID 872322
4-[[2-(3-methoxyphenyl)acetyl]amino]-N-methylbenzamide
CID 26679644
1-(3,4-diaminophenyl)-3-(3-methoxyphenyl)urea
CID 155694037
N-[3-[(3-methoxyphenyl)carbamoylamino]phenyl]acetamide
CID 6467465
1-N-[4-(dimethylamino)phenyl]-4-N-(3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109050069
4-acetyl-N-(3-methoxyphenyl)benzamide
CID 16640996
3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide
CID 18153307
3-N-(3-methoxyphenyl)-1-N-(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057620
4-[[[amino-(3-methoxyanilino)methylidene]amino]methyl]-N-methylbenzamide
CID 111048346
N-[2-[[4-[(3-methoxyphenyl)carbamoylamino]benzoyl]amino]ethyl]thiophene-2-carboxamide
CID 121063056

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide?
The IUPAC name of 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide (CID 17180805) is 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide.
What is the SMILES notation for 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide?
The canonical SMILES for 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide is CNC(=O)c1ccc(NC(=O)Nc2cccc(OC)c2)cc1.
What is the InChIKey of 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide?
The InChIKey is NRMHISKVDMLWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-17-15(20)11-6-8-12(9-7-11)18-16(21)19-13-4-3-5-14(10-13)22-2/h3-10H,1-2H3,(H,17,20)(H2,18,19,21).
What are the key properties of 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide?
4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide 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 4-[(3-methoxyphenyl)carbamoylamino]-N-methylbenzamide is sourced from PubChem (CID 17180805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).