4-[(4-azidobenzoyl)amino]benzamide

C14H11N5O2 — CID 169326653

IUPAC4-[(4-azidobenzoyl)amino]benzamide
SMILES[N-]=[N+]=Nc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C14H11N5O2/c15-13(20)9-1-5-11(6-2-9)17-14(21)10-3-7-12(8-4-10)18-19-16/h1-8H,(H2,15,20)(H,17,21)
InChIKeyKSEOVHWHFVDOJQ-UHFFFAOYSA-N
MW281.28 g/mol
LogP2.98
Rot. Bonds4

About 4-[(4-azidobenzoyl)amino]benzamide

4-[(4-azidobenzoyl)amino]benzamide (PubChem CID 169326653) has the molecular formula C14H11N5O2 and a molecular weight of 281.28 g/mol. Its IUPAC name is 4-[(4-azidobenzoyl)amino]benzamide.

Molecular Properties

Compound Name4-[(4-azidobenzoyl)amino]benzamide
PubChem CID169326653
Molecular FormulaC14H11N5O2
Molecular Weight281.28 g/mol
Exact Mass281.09
IUPAC Name4-[(4-azidobenzoyl)amino]benzamide
SMILES[N-]=[N+]=Nc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C14H11N5O2/c15-13(20)9-1-5-11(6-2-9)17-14(21)10-3-7-12(8-4-10)18-19-16/h1-8H,(H2,15,20)(H,17,21)
InChIKeyKSEOVHWHFVDOJQ-UHFFFAOYSA-N
XLogP2.98
TPSA120.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.28
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

1-N,4-N-bis(4-carbamoylphenyl)benzene-1,4-dicarboxamide
CID 1272826
4-tert-butyl-N-(4-carbamoylphenyl)benzamide
CID 3252757
N-(4-azidophenyl)acetamide
CID 4315161
4-N-(4-acetamidophenyl)benzene-1,4-dicarboxamide
CID 27648779
methyl 4-[(4-carbamoylbenzoyl)amino]benzoate
CID 30845691
methyl 4-[(4-carbamoylphenyl)carbamoyl]benzoate
CID 5085217
2-[[5-[(4-azidobenzoyl)amino]-2-pyridinyl]oxy]acetic acid
CID 23499531
4-[[4-[2-(dicyanomethylidene)hydrazinyl]benzoyl]amino]benzamide
CID 169341949
4-amino-N-[4-[[4-[(4-aminobenzoyl)amino]phenyl]diazenyl]phenyl]benzamide
CID 134597340
N-(4-aminophenyl)-4-(diaminomethylideneamino)benzamide
CID 12925886
4-[[4-(difluoromethoxy)benzoyl]amino]benzamide
CID 842852
4-acetamido-N-[4-[(4-acetamidophenyl)diazenyl]phenyl]benzamide
CID 130360401

Frequently Asked Questions

What is the IUPAC name of 4-[(4-azidobenzoyl)amino]benzamide?
The IUPAC name of 4-[(4-azidobenzoyl)amino]benzamide (CID 169326653) is 4-[(4-azidobenzoyl)amino]benzamide.
What is the SMILES notation for 4-[(4-azidobenzoyl)amino]benzamide?
The canonical SMILES for 4-[(4-azidobenzoyl)amino]benzamide is [N-]=[N+]=Nc1ccc(C(=O)Nc2ccc(C(N)=O)cc2)cc1.
What is the InChIKey of 4-[(4-azidobenzoyl)amino]benzamide?
The InChIKey is KSEOVHWHFVDOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O2/c15-13(20)9-1-5-11(6-2-9)17-14(21)10-3-7-12(8-4-10)18-19-16/h1-8H,(H2,15,20)(H,17,21).
What are the key properties of 4-[(4-azidobenzoyl)amino]benzamide?
4-[(4-azidobenzoyl)amino]benzamide has a molecular weight of 281.28 g/mol, XLogP of 2.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-azidobenzoyl)amino]benzamide is sourced from PubChem (CID 169326653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).