2-[(3,5-difluorophenyl)carbamoylamino]benzamide

C14H11F2N3O2 — CID 156854272

IUPAC2-[(3,5-difluorophenyl)carbamoylamino]benzamide
SMILESNC(=O)c1ccccc1NC(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C14H11F2N3O2/c15-8-5-9(16)7-10(6-8)18-14(21)19-12-4-2-1-3-11(12)13(17)20/h1-7H,(H2,17,20)(H2,18,19,21)
InChIKeyRLYJBHQRHYAUEO-UHFFFAOYSA-N
MW291.26 g/mol
LogP2.71
Rot. Bonds3

About 2-[(3,5-difluorophenyl)carbamoylamino]benzamide

2-[(3,5-difluorophenyl)carbamoylamino]benzamide (PubChem CID 156854272) has the molecular formula C14H11F2N3O2 and a molecular weight of 291.26 g/mol. Its IUPAC name is 2-[(3,5-difluorophenyl)carbamoylamino]benzamide.

Molecular Properties

Compound Name2-[(3,5-difluorophenyl)carbamoylamino]benzamide
PubChem CID156854272
Molecular FormulaC14H11F2N3O2
Molecular Weight291.26 g/mol
Exact Mass291.08
IUPAC Name2-[(3,5-difluorophenyl)carbamoylamino]benzamide
SMILESNC(=O)c1ccccc1NC(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C14H11F2N3O2/c15-8-5-9(16)7-10(6-8)18-14(21)19-12-4-2-1-3-11(12)13(17)20/h1-7H,(H2,17,20)(H2,18,19,21)
InChIKeyRLYJBHQRHYAUEO-UHFFFAOYSA-N
XLogP2.71
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.26
LogP ≤ 52.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3,5-difluorophenyl)carbamoylamino]benzoic acid
CID 61189563
2-[(3,5-difluorophenyl)carbamoylamino]-N-propylbenzamide
CID 166747501
4-fluoro-2-[(3-fluorophenyl)carbamoylamino]benzamide
CID 156854097
2-[(4-fluorophenyl)carbamothioylamino]benzamide
CID 969266
2-[(3-fluorophenyl)methylcarbamoylamino]benzamide
CID 108898547
N-(2-carbamoylphenyl)-N'-(2,5-difluorophenyl)oxamide
CID 108529490
1-(2,4-difluorophenyl)-3-(3,5-difluorophenyl)urea
CID 46859669
2-[(2,3-dimethylphenyl)carbamoylamino]benzamide
CID 127573496
1-(3,5-difluorophenyl)-3-[5-fluoro-2-(hydrazinecarbonyl)phenyl]urea
CID 156854203
2-(1,2-oxazol-5-ylcarbamoylamino)benzamide
CID 108814132
2-[2-(4-fluorophenyl)ethylcarbamoylamino]benzamide
CID 108902156
1-(3-aminophenyl)-3-(3,5-difluorophenyl)urea
CID 29042158

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-difluorophenyl)carbamoylamino]benzamide?
The IUPAC name of 2-[(3,5-difluorophenyl)carbamoylamino]benzamide (CID 156854272) is 2-[(3,5-difluorophenyl)carbamoylamino]benzamide.
What is the SMILES notation for 2-[(3,5-difluorophenyl)carbamoylamino]benzamide?
The canonical SMILES for 2-[(3,5-difluorophenyl)carbamoylamino]benzamide is NC(=O)c1ccccc1NC(=O)Nc1cc(F)cc(F)c1.
What is the InChIKey of 2-[(3,5-difluorophenyl)carbamoylamino]benzamide?
The InChIKey is RLYJBHQRHYAUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N3O2/c15-8-5-9(16)7-10(6-8)18-14(21)19-12-4-2-1-3-11(12)13(17)20/h1-7H,(H2,17,20)(H2,18,19,21).
What are the key properties of 2-[(3,5-difluorophenyl)carbamoylamino]benzamide?
2-[(3,5-difluorophenyl)carbamoylamino]benzamide has a molecular weight of 291.26 g/mol, XLogP of 2.71, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-difluorophenyl)carbamoylamino]benzamide is sourced from PubChem (CID 156854272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).