3-methyl-9-oxidocarbazole

C13H10NO- — CID 166517305

IUPAC3-methyl-9-oxidocarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2[O-]
InChIInChI=1S/C13H10NO/c1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14(13)15/h2-8H,1H3/q-1
InChIKeyUYYCVNSUKDGEKL-UHFFFAOYSA-N
MW196.23 g/mol
LogP3.45
Rot. Bonds

About 3-methyl-9-oxidocarbazole

3-methyl-9-oxidocarbazole (PubChem CID 166517305) has the molecular formula C13H10NO- and a molecular weight of 196.23 g/mol. Its IUPAC name is 3-methyl-9-oxidocarbazole.

Molecular Properties

Compound Name3-methyl-9-oxidocarbazole
PubChem CID166517305
Molecular FormulaC13H10NO-
Molecular Weight196.23 g/mol
Exact Mass196.08
IUPAC Name3-methyl-9-oxidocarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2[O-]
InChIInChI=1S/C13H10NO/c1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14(13)15/h2-8H,1H3/q-1
InChIKeyUYYCVNSUKDGEKL-UHFFFAOYSA-N
XLogP3.45
TPSA27.99 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}

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Related Compounds

16,20-dimethyl-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14(19),15,17,21,23-dodecaene
CID 164939565
3-methyl-9-[2-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 58771355
5-methyl-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 59221908
9-[4,6-bis(3-methylcarbazol-9-yl)-1,3,5-triazin-2-yl]-3-methylcarbazole
CID 155367112
9-(4-carbazol-9-ylbutyl)-3,6-dimethylcarbazole
CID 58771349
3-methyl-9-[3-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 59399075
3,6-dimethyl-9-[2-[2-(3-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 170060425
9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole
CID 170201849
2-methyl-9-phenylcarbazole;3-methyl-9-phenylcarbazole
CID 159508303
3-methyl-9-(4-methylphenyl)-6-[9-(4-methylphenyl)-6-[9-(4-methylphenyl)carbazol-3-yl]carbazol-3-yl]carbazole
CID 70866701
9-(2,4-dimethylphenyl)-1,3-dimethylcarbazole
CID 146638363
2-methyl-7-(4-methylphenyl)-5-phenylindolo[2,3-b]carbazole
CID 71140488

Frequently Asked Questions

What is the IUPAC name of 3-methyl-9-oxidocarbazole?
The IUPAC name of 3-methyl-9-oxidocarbazole (CID 166517305) is 3-methyl-9-oxidocarbazole.
What is the SMILES notation for 3-methyl-9-oxidocarbazole?
The canonical SMILES for 3-methyl-9-oxidocarbazole is Cc1ccc2c(c1)c1ccccc1n2[O-].
What is the InChIKey of 3-methyl-9-oxidocarbazole?
The InChIKey is UYYCVNSUKDGEKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10NO/c1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14(13)15/h2-8H,1H3/q-1.
What are the key properties of 3-methyl-9-oxidocarbazole?
3-methyl-9-oxidocarbazole has a molecular weight of 196.23 g/mol, XLogP of 3.45, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-9-oxidocarbazole is sourced from PubChem (CID 166517305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).