2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol

C14H19NO — CID 117205237

IUPAC2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol
SMILESCc1cn(C(C)C)c2c(CCO)cccc12
InChIInChI=1S/C14H19NO/c1-10(2)15-9-11(3)13-6-4-5-12(7-8-16)14(13)15/h4-6,9-10,16H,7-8H2,1-3H3
InChIKeyQKMAMZBYFINQKM-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.07
Rot. Bonds3

About 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol

2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol (PubChem CID 117205237) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol.

Molecular Properties

Compound Name2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol
PubChem CID117205237
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol
SMILESCc1cn(C(C)C)c2c(CCO)cccc12
InChIInChI=1S/C14H19NO/c1-10(2)15-9-11(3)13-6-4-5-12(7-8-16)14(13)15/h4-6,9-10,16H,7-8H2,1-3H3
InChIKeyQKMAMZBYFINQKM-UHFFFAOYSA-N
XLogP3.07
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(7-bromo-1-propan-2-ylindol-3-yl)ethanol
CID 117197647
3-(hydroxymethyl)-1-propan-2-ylindol-7-ol
CID 117182602
2-(3-bromo-1-methylindol-7-yl)ethanol
CID 117388124
3-(methoxymethyl)-7-methyl-1-propan-2-ylindole
CID 117186336
[3-[(dimethylamino)methyl]-1-propan-2-ylindol-7-yl]methanamine
CID 117182193
[3-(methylaminomethyl)-1-propan-2-ylindol-7-yl]methanamine
CID 117182192
ethane;2-naphthalen-1-ylethanol
CID 145119048
7-methyl-1-propan-2-yl-3-(propan-2-ylsulfonylmethyl)indole
CID 117186293
chloroform;2-(2-methylphenyl)ethanol
CID 68926647
[3-(methylsulfonylmethyl)-1-propan-2-ylindol-7-yl]methanamine
CID 117182209
1-propan-2-yl-3-propylindole-7-carboxylic acid
CID 83945413
3-(aminooxymethyl)-1-propan-2-ylindol-7-ol
CID 117197927

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol?
The IUPAC name of 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol (CID 117205237) is 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol.
What is the SMILES notation for 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol?
The canonical SMILES for 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol is Cc1cn(C(C)C)c2c(CCO)cccc12.
What is the InChIKey of 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol?
The InChIKey is QKMAMZBYFINQKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-10(2)15-9-11(3)13-6-4-5-12(7-8-16)14(13)15/h4-6,9-10,16H,7-8H2,1-3H3.
What are the key properties of 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol?
2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol has a molecular weight of 217.31 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-1-propan-2-ylindol-7-yl)ethanol is sourced from PubChem (CID 117205237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).