[(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium

C23H24N5+ — CID 142938701

IUPAC[(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium
SMILESCc1cc(C)c(Cn2c3ccccc3c3cc(C(=[NH2+])/N=N/N)ccc32)c(C)c1
InChIInChI=1S/C23H23N5/c1-14-10-15(2)20(16(3)11-14)13-28-21-7-5-4-6-18(21)19-12-17(8-9-22(19)28)23(24)26-27-25/h4-12H,13H2,1-3H3,(H3,24,25,26)/p+1
InChIKeyDGOHTASKMVZBJF-UHFFFAOYSA-O
MW370.48 g/mol
LogP3.60
Rot. Bonds3

About [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium

[(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium (PubChem CID 142938701) has the molecular formula C23H24N5+ and a molecular weight of 370.48 g/mol. Its IUPAC name is [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium.

Molecular Properties

Compound Name[(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium
PubChem CID142938701
Molecular FormulaC23H24N5+
Molecular Weight370.48 g/mol
Exact Mass370.20
IUPAC Name[(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium
SMILESCc1cc(C)c(Cn2c3ccccc3c3cc(C(=[NH2+])/N=N/N)ccc32)c(C)c1
InChIInChI=1S/C23H23N5/c1-14-10-15(2)20(16(3)11-14)13-28-21-7-5-4-6-18(21)19-12-17(8-9-22(19)28)23(24)26-27-25/h4-12H,13H2,1-3H3,(H3,24,25,26)/p+1
InChIKeyDGOHTASKMVZBJF-UHFFFAOYSA-O
XLogP3.60
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.48
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N'-amino-9-[(4-methylphenyl)methyl]carbazole-3-carboximidamide
CID 143271307
9-[(2-chlorophenyl)methyl]-N-hydrazinylidenecarbazole-3-carboximidamide
CID 142223725
N-hydrazinylidene-9-[[4-(1-hydroxyethenyl)phenyl]methyl]carbazole-3-carboximidamide
CID 142938962
[(aminodiazenyl)-(1-benzylindol-5-yl)methylidene]azanium
CID 163765370
9-[(2-methylphenyl)methyl]carbazole-3-carboximidamide
CID 142911316
[(aminodiazenyl)-[9-[(4-bromocyclohexyl)methyl]carbazol-3-yl]methylidene]azanide
CID 163858199
9-[(2,5-dimethylphenyl)methyl]carbazole
CID 174908792
9-[[3,5-bis(carbazol-9-ylmethyl)-2,4,6-triethylphenyl]methyl]carbazole
CID 102414026
4-benzoyl-6-chloro-1-[(2,4,6-trimethylphenyl)methyl]quinolin-2-one
CID 132850354
4-benzoyl-6-bromo-1-[(2,4,6-trimethylphenyl)methyl]quinolin-2-one
CID 132850355
1-(9-propylcarbazol-3-yl)butan-1-one
CID 145412526
9-ethyl-3-[(E)-2-(9-ethylcarbazol-3-yl)-1,2-diphenylethenyl]carbazole
CID 102220131

Frequently Asked Questions

What is the IUPAC name of [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium?
The IUPAC name of [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium (CID 142938701) is [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium.
What is the SMILES notation for [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium?
The canonical SMILES for [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium is Cc1cc(C)c(Cn2c3ccccc3c3cc(C(=[NH2+])/N=N/N)ccc32)c(C)c1.
What is the InChIKey of [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium?
The InChIKey is DGOHTASKMVZBJF-UHFFFAOYSA-O. The full InChI is InChI=1S/C23H23N5/c1-14-10-15(2)20(16(3)11-14)13-28-21-7-5-4-6-18(21)19-12-17(8-9-22(19)28)23(24)26-27-25/h4-12H,13H2,1-3H3,(H3,24,25,26)/p+1.
What are the key properties of [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium?
[(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium has a molecular weight of 370.48 g/mol, XLogP of 3.60, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(aminodiazenyl)-[9-[(2,4,6-trimethylphenyl)methyl]carbazol-3-yl]methylidene]azanium is sourced from PubChem (CID 142938701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).