7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol

C17H16N2O — CID 162754828

IUPAC7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol
SMILES[H]/N=C/c1cc2c3cc(O)ccc3n(C)c2c(C)c1C=C
InChIInChI=1S/C17H16N2O/c1-4-13-10(2)17-15(7-11(13)9-18)14-8-12(20)5-6-16(14)19(17)3/h4-9,18,20H,1H2,2-3H3/b18-9+
InChIKeyYYCXATSZDMFXAU-GIJQJNRQSA-N
MW264.33 g/mol
LogP3.99
Rot. Bonds2

About 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol

7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol (PubChem CID 162754828) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol.

Molecular Properties

Compound Name7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol
PubChem CID162754828
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC Name7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol
SMILES[H]/N=C/c1cc2c3cc(O)ccc3n(C)c2c(C)c1C=C
InChIInChI=1S/C17H16N2O/c1-4-13-10(2)17-15(7-11(13)9-18)14-8-12(20)5-6-16(14)19(17)3/h4-9,18,20H,1H2,2-3H3/b18-9+
InChIKeyYYCXATSZDMFXAU-GIJQJNRQSA-N
XLogP3.99
TPSA49.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-(hydroxymethyl)-5,6-dimethylpyrido[4,3-b]carbazol-9-ol
CID 71509562
7-amino-8,9-dimethyl-6-nitrocarbazol-3-ol
CID 71415856
2-[2-(dimethylamino)ethyl]-5,6-dimethyl-1H-pyrido[4,3-b]carbazol-9-ol
CID 141148291
N-(5-hydroxy-1,2-dimethylindol-3-yl)acetamide
CID 12616715
3-ethenyl-1,2,5-trimethylindole
CID 89379856
ethane;3-fluoro-1,2-dimethylindol-5-ol
CID 145147289
6-hydroxy-1,2-dimethylquinolin-4-one
CID 130032779
9-ethyl-1-methylcarbazole-3,6-diol
CID 69337155
6-hydroxy-9-methyl-2H-pyrido[3,4-b]indol-3-one
CID 115028655
5,6-dimethyl-1-(4-nitrophenyl)pyrido[4,3-b]carbazol-9-ol
CID 11703666
2,5,6-trimethyl-1-(4-nitrophenyl)pyrido[4,3-b]carbazol-2-ium-9-ol
CID 11548196
3-ethenyl-1,2,6-trimethylquinolin-4-one
CID 126606942

Frequently Asked Questions

What is the IUPAC name of 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol?
The IUPAC name of 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol (CID 162754828) is 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol.
What is the SMILES notation for 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol?
The canonical SMILES for 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol is [H]/N=C/c1cc2c3cc(O)ccc3n(C)c2c(C)c1C=C.
What is the InChIKey of 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol?
The InChIKey is YYCXATSZDMFXAU-GIJQJNRQSA-N. The full InChI is InChI=1S/C17H16N2O/c1-4-13-10(2)17-15(7-11(13)9-18)14-8-12(20)5-6-16(14)19(17)3/h4-9,18,20H,1H2,2-3H3/b18-9+.
What are the key properties of 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol?
7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol has a molecular weight of 264.33 g/mol, XLogP of 3.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethenyl-6-methanimidoyl-8,9-dimethylcarbazol-3-ol is sourced from PubChem (CID 162754828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).