[1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene

C14H13N5 — CID 91226838

IUPAC[1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene
SMILES[H]/N=N/Cc1ccc2c([nH]c3ccccc32)c1C/N=N/[H]
InChIInChI=1S/C14H13N5/c15-17-7-9-5-6-11-10-3-1-2-4-13(10)19-14(11)12(9)8-18-16/h1-6,15-16,19H,7-8H2/b17-15+,18-16+
InChIKeyNMNVJAZSUKPAQN-YTEMWHBBSA-N
MW251.29 g/mol
LogP4.38
Rot. Bonds4

About [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene

[1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene (PubChem CID 91226838) has the molecular formula C14H13N5 and a molecular weight of 251.29 g/mol. Its IUPAC name is [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene.

Molecular Properties

Compound Name[1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene
PubChem CID91226838
Molecular FormulaC14H13N5
Molecular Weight251.29 g/mol
Exact Mass251.12
IUPAC Name[1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene
SMILES[H]/N=N/Cc1ccc2c([nH]c3ccccc32)c1C/N=N/[H]
InChIInChI=1S/C14H13N5/c15-17-7-9-5-6-11-10-3-1-2-4-13(10)19-14(11)12(9)8-18-16/h1-6,15-16,19H,7-8H2/b17-15+,18-16+
InChIKeyNMNVJAZSUKPAQN-YTEMWHBBSA-N
XLogP4.38
TPSA88.21 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 54.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-2-nonyl-9H-carbazole
CID 142709978
(1-ethyl-9H-carbazol-2-yl)boronic acid
CID 141303113
16-azahexacyclo[12.11.0.02,11.05,10.015,23.017,22]pentacosa-1(14),2(11),3,5,7,9,12,15(23),17,19,21,24-dodecaene
CID 86153881
9H-carbazol-1-ylmethanol
CID 10987211
2-(1-methyl-9H-carbazol-2-yl)acetic acid
CID 54249777
23-azaoctacyclo[16.15.0.02,15.05,14.06,11.021,33.022,30.024,29]tritriaconta-1(18),2(15),3,5(14),6,8,10,12,16,19,21(33),22(30),24,26,28,31-hexadecaene
CID 141416725
9H-carbazole
CID 66668984
1-but-3-ynyl-9H-carbazole
CID 173036439
1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
bis(9H-carbazole);platinum(2+)
CID 175826437
9H-carbazole;copper
CID 159878189
azane;1,2-dimethyl-9H-carbazole
CID 174760951

Frequently Asked Questions

What is the IUPAC name of [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene?
The IUPAC name of [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene (CID 91226838) is [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene.
What is the SMILES notation for [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene?
The canonical SMILES for [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene is [H]/N=N/Cc1ccc2c([nH]c3ccccc32)c1C/N=N/[H].
What is the InChIKey of [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene?
The InChIKey is NMNVJAZSUKPAQN-YTEMWHBBSA-N. The full InChI is InChI=1S/C14H13N5/c15-17-7-9-5-6-11-10-3-1-2-4-13(10)19-14(11)12(9)8-18-16/h1-6,15-16,19H,7-8H2/b17-15+,18-16+.
What are the key properties of [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene?
[1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene has a molecular weight of 251.29 g/mol, XLogP of 4.38, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(diazenylmethyl)-9H-carbazol-2-yl]methyldiazene is sourced from PubChem (CID 91226838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).