4-azido-N-(4-methoxyphenyl)aniline

C13H12N4O — CID 18432095

IUPAC4-azido-N-(4-methoxyphenyl)aniline
SMILESCOc1ccc(Nc2ccc(N=[N+]=[N-])cc2)cc1
InChIInChI=1S/C13H12N4O/c1-18-13-8-6-11(7-9-13)15-10-2-4-12(5-3-10)16-17-14/h2-9,15H,1H3
InChIKeyMHQFHKKRPPURPO-UHFFFAOYSA-N
MW240.27 g/mol
LogP4.38
Rot. Bonds4

About 4-azido-N-(4-methoxyphenyl)aniline

4-azido-N-(4-methoxyphenyl)aniline (PubChem CID 18432095) has the molecular formula C13H12N4O and a molecular weight of 240.27 g/mol. Its IUPAC name is 4-azido-N-(4-methoxyphenyl)aniline.

Molecular Properties

Compound Name4-azido-N-(4-methoxyphenyl)aniline
PubChem CID18432095
Molecular FormulaC13H12N4O
Molecular Weight240.27 g/mol
Exact Mass240.10
IUPAC Name4-azido-N-(4-methoxyphenyl)aniline
SMILESCOc1ccc(Nc2ccc(N=[N+]=[N-])cc2)cc1
InChIInChI=1S/C13H12N4O/c1-18-13-8-6-11(7-9-13)15-10-2-4-12(5-3-10)16-17-14/h2-9,15H,1H3
InChIKeyMHQFHKKRPPURPO-UHFFFAOYSA-N
XLogP4.38
TPSA70.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 54.38
H-Bond Donors ≤ 51
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'}

Analyze 4-azido-N-(4-methoxyphenyl)aniline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-diazenyl-N-(4-methoxyphenyl)aniline
CID 5103664
methyl N-(4-azidophenyl)carbamate
CID 142621312
1-azido-4-tert-butylbenzene;4-tert-butyl-2,6-dimethylphenol;1-tert-butyl-4-methoxybenzene;methane
CID 162092895
(3S,4R)-4-(4-azidophenyl)-3-hydroxy-1-(4-methoxyphenyl)azetidin-2-one
CID 11335875
N-(4-methoxyphenyl)-4-[1,2,2-tris[4-(4-methoxyanilino)phenyl]ethenyl]aniline
CID 101376712
N-(4-azidophenyl)acetamide
CID 4315161
N-(4-methoxyphenyl)-4-[(4-nitrophenyl)diazenyl]aniline
CID 163545972
N-(4-methoxyphenyl)-4-phenylaniline
CID 57004376
4-methoxy-N-[4-[(2-methylpropan-2-yl)oxy]phenyl]aniline
CID 82535713
zinc;bis(4-(4-methoxyanilino)benzenediazonium);tetrachloride
CID 6453830
2-(4-azidoanilino)propanoic acid
CID 90146242
2-(4-azidophenoxy)-4,6-dimethylpyrimidine
CID 150267035

Frequently Asked Questions

What is the IUPAC name of 4-azido-N-(4-methoxyphenyl)aniline?
The IUPAC name of 4-azido-N-(4-methoxyphenyl)aniline (CID 18432095) is 4-azido-N-(4-methoxyphenyl)aniline.
What is the SMILES notation for 4-azido-N-(4-methoxyphenyl)aniline?
The canonical SMILES for 4-azido-N-(4-methoxyphenyl)aniline is COc1ccc(Nc2ccc(N=[N+]=[N-])cc2)cc1.
What is the InChIKey of 4-azido-N-(4-methoxyphenyl)aniline?
The InChIKey is MHQFHKKRPPURPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O/c1-18-13-8-6-11(7-9-13)15-10-2-4-12(5-3-10)16-17-14/h2-9,15H,1H3.
What are the key properties of 4-azido-N-(4-methoxyphenyl)aniline?
4-azido-N-(4-methoxyphenyl)aniline has a molecular weight of 240.27 g/mol, XLogP of 4.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-azido-N-(4-methoxyphenyl)aniline is sourced from PubChem (CID 18432095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).