6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol

C19H21NO2 — CID 11208660

IUPAC6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol
SMILESCOc1ccc2[nH]c3cc(O)c(C)cc3c2c1CC=C(C)C
InChIInChI=1S/C19H21NO2/c1-11(2)5-6-13-18(22-4)8-7-15-19(13)14-9-12(3)17(21)10-16(14)20-15/h5,7-10,20-21H,6H2,1-4H3
InChIKeyIYAPESHZKSLHCA-UHFFFAOYSA-N
MW295.38 g/mol
LogP4.85
Rot. Bonds3

About 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol

6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol (PubChem CID 11208660) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol.

Molecular Properties

Compound Name6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol
PubChem CID11208660
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC Name6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol
SMILESCOc1ccc2[nH]c3cc(O)c(C)cc3c2c1CC=C(C)C
InChIInChI=1S/C19H21NO2/c1-11(2)5-6-13-18(22-4)8-7-15-19(13)14-9-12(3)17(21)10-16(14)20-15/h5,7-10,20-21H,6H2,1-4H3
InChIKeyIYAPESHZKSLHCA-UHFFFAOYSA-N
XLogP4.85
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Mahanimbine
CID 167963
8-methoxy-3,3,5-trimethyl-11H-pyrano(3,2-a)carbazole
CID 97487
Girinimbine
CID 96943
Koenidine
CID 278055
4-Hydroxycarbazole
CID 104251
3,8-Dimethyl-3-(4-methylpent-3-en-1-yl)-3,11-dihydropyrano(3,2-a)carbazol-9-ol
CID 375148
(R)-Mahanine
CID 375151
2-methoxy-3-methyl-9H-carbazole
CID 11052947
5-Methoxy-2-phenylindole
CID 292850
Koenoline
CID 375152
Mahanimbicine
CID 4072580
2-(4-Hydroxy-3,5-dimethylphenyl)-5-methoxy-3-methylindole
CID 128480

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol?
The IUPAC name of 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol (CID 11208660) is 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol.
What is the SMILES notation for 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol?
The canonical SMILES for 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol is COc1ccc2[nH]c3cc(O)c(C)cc3c2c1CC=C(C)C.
What is the InChIKey of 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol?
The InChIKey is IYAPESHZKSLHCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c1-11(2)5-6-13-18(22-4)8-7-15-19(13)14-9-12(3)17(21)10-16(14)20-15/h5,7-10,20-21H,6H2,1-4H3.
What are the key properties of 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol?
6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol has a molecular weight of 295.38 g/mol, XLogP of 4.85, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3-methyl-5-(3-methylbut-2-enyl)-9H-carbazol-2-ol is sourced from PubChem (CID 11208660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).