2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol

C15H19NO — CID 141282093

IUPAC2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol
SMILESCC1CCc2c(n(CCO)c3ccccc23)C1
InChIInChI=1S/C15H19NO/c1-11-6-7-13-12-4-2-3-5-14(12)16(8-9-17)15(13)10-11/h2-5,11,17H,6-10H2,1H3
InChIKeyPWWYNNZYZHMPTR-UHFFFAOYSA-N
MW229.32 g/mol
LogP2.76
Rot. Bonds2

About 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol

2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol (PubChem CID 141282093) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol.

Molecular Properties

Compound Name2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol
PubChem CID141282093
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol
SMILESCC1CCc2c(n(CCO)c3ccccc23)C1
InChIInChI=1S/C15H19NO/c1-11-6-7-13-12-4-2-3-5-14(12)16(8-9-17)15(13)10-11/h2-5,11,17H,6-10H2,1H3
InChIKeyPWWYNNZYZHMPTR-UHFFFAOYSA-N
XLogP2.76
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol?
The IUPAC name of 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol (CID 141282093) is 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol.
What is the SMILES notation for 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol?
The canonical SMILES for 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol is CC1CCc2c(n(CCO)c3ccccc23)C1.
What is the InChIKey of 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol?
The InChIKey is PWWYNNZYZHMPTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-11-6-7-13-12-4-2-3-5-14(12)16(8-9-17)15(13)10-11/h2-5,11,17H,6-10H2,1H3.
What are the key properties of 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol?
2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol has a molecular weight of 229.32 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1,2,3,4-tetrahydrocarbazol-9-yl)ethanol is sourced from PubChem (CID 141282093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).