2-(4,7-dimethyl-3-propylindol-1-yl)ethanol

C15H21NO — CID 83944887

IUPAC2-(4,7-dimethyl-3-propylindol-1-yl)ethanol
SMILESCCCc1cn(CCO)c2c(C)ccc(C)c12
InChIInChI=1S/C15H21NO/c1-4-5-13-10-16(8-9-17)15-12(3)7-6-11(2)14(13)15/h6-7,10,17H,4-5,8-9H2,1-3H3
InChIKeyGBCSZPBIXROBDH-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.20
Rot. Bonds4

About 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol

2-(4,7-dimethyl-3-propylindol-1-yl)ethanol (PubChem CID 83944887) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol.

Molecular Properties

Compound Name2-(4,7-dimethyl-3-propylindol-1-yl)ethanol
PubChem CID83944887
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name2-(4,7-dimethyl-3-propylindol-1-yl)ethanol
SMILESCCCc1cn(CCO)c2c(C)ccc(C)c12
InChIInChI=1S/C15H21NO/c1-4-5-13-10-16(8-9-17)15-12(3)7-6-11(2)14(13)15/h6-7,10,17H,4-5,8-9H2,1-3H3
InChIKeyGBCSZPBIXROBDH-UHFFFAOYSA-N
XLogP3.20
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4,7-dimethyl-3-propylindol-1-yl)propan-1-amine
CID 83948548
3-[1-(3-aminopropyl)-4,7-dimethylindol-3-yl]propan-1-ol
CID 83944932
2-[4,7-dimethyl-3-(2-pyrrolidin-1-ylethyl)indol-1-yl]acetic acid
CID 83947576
3-(6-chloro-7-methyl-3-propylindol-1-yl)propan-1-ol
CID 83945161
1-(1-butyl-4,7-dimethylindol-3-yl)ethanol
CID 83944914
2-(4,7-dimethylindol-1-yl)ethanol
CID 83944885
2-[4,7-dimethyl-3-(3-piperazin-1-ylpropyl)indol-1-yl]acetic acid
CID 83947579
1,3-dibutyl-6-methylindole-7-carboxylic acid
CID 83946379
3-(3-butyl-6-chloro-7-methylindol-1-yl)propan-1-ol
CID 83945163
1-[1-(3-aminopropyl)-4,7-dimethylindol-3-yl]ethanol
CID 83944930
2-[6-chloro-1-(2-hydroxyethyl)-7-methylindol-3-yl]acetic acid
CID 83945122
3-(5,7-dimethyl-3-propylindol-1-yl)propan-1-amine
CID 83948572

Frequently Asked Questions

What is the IUPAC name of 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol?
The IUPAC name of 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol (CID 83944887) is 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol.
What is the SMILES notation for 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol?
The canonical SMILES for 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol is CCCc1cn(CCO)c2c(C)ccc(C)c12.
What is the InChIKey of 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol?
The InChIKey is GBCSZPBIXROBDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-4-5-13-10-16(8-9-17)15-12(3)7-6-11(2)14(13)15/h6-7,10,17H,4-5,8-9H2,1-3H3.
What are the key properties of 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol?
2-(4,7-dimethyl-3-propylindol-1-yl)ethanol has a molecular weight of 231.34 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,7-dimethyl-3-propylindol-1-yl)ethanol is sourced from PubChem (CID 83944887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).