6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol

C15H19NO2 — CID 65333336

IUPAC6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol
SMILESCOc1ccc2[nH]c3c(c2c1)C(O)CC(C)(C)C3
InChIInChI=1S/C15H19NO2/c1-15(2)7-12-14(13(17)8-15)10-6-9(18-3)4-5-11(10)16-12/h4-6,13,16-17H,7-8H2,1-3H3
InChIKeyWHGBKGPGGBUUCT-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.18
Rot. Bonds1

About 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol

6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol (PubChem CID 65333336) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol.

Molecular Properties

Compound Name6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol
PubChem CID65333336
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol
SMILESCOc1ccc2[nH]c3c(c2c1)C(O)CC(C)(C)C3
InChIInChI=1S/C15H19NO2/c1-15(2)7-12-14(13(17)8-15)10-6-9(18-3)4-5-11(10)16-12/h4-6,13,16-17H,7-8H2,1-3H3
InChIKeyWHGBKGPGGBUUCT-UHFFFAOYSA-N
XLogP3.18
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

6-methoxy-N,2,2-trimethyl-1,3,4,9-tetrahydrocarbazol-4-amine
CID 65333211
4-hydroxy-6-methoxy-2,3,4,9-tetrahydro-1H-carbazole-2-carboxylic acid
CID 84638532
6-methoxy-3,3-dimethyl-1,2,4,9-tetrahydrocarbazole
CID 65335451
6-methoxy-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-4-carboxylic acid;hydrochloride
CID 140799634
2,2,5,7-tetramethyl-1,3,4,9-tetrahydrocarbazol-4-ol
CID 65332947
6-methoxy-2,3,4,9-tetrahydro-1H-carbazol-4-amine
CID 65332552
6-methoxy-9H-carbazol-3-ol
CID 142959347
1-(6-methoxy-2,3,4,9-tetrahydro-1H-carbazol-4-yl)-N-methylmethanamine
CID 84741592
3-fluoro-6-methoxy-9H-carbazole
CID 171714917
7-methoxy-3,15-diazahexacyclo[11.11.0.02,10.04,9.014,22.016,21]tetracosa-1(13),2(10),4(9),5,7,11,14(22),16,18,20,23-undecaene
CID 24774105
(2R)-9-methoxy-2,3-dimethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole
CID 168957107
5-(5-methoxy-2-methyl-1H-indol-3-yl)-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 67794349

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol?
The IUPAC name of 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol (CID 65333336) is 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol.
What is the SMILES notation for 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol?
The canonical SMILES for 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol is COc1ccc2[nH]c3c(c2c1)C(O)CC(C)(C)C3.
What is the InChIKey of 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol?
The InChIKey is WHGBKGPGGBUUCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-15(2)7-12-14(13(17)8-15)10-6-9(18-3)4-5-11(10)16-12/h4-6,13,16-17H,7-8H2,1-3H3.
What are the key properties of 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol?
6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol has a molecular weight of 245.32 g/mol, XLogP of 3.18, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2,2-dimethyl-1,3,4,9-tetrahydrocarbazol-4-ol is sourced from PubChem (CID 65333336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).