2-(1-ethyl-6-methylindol-2-yl)propan-2-ol

C14H19NO — CID 117122681

IUPAC2-(1-ethyl-6-methylindol-2-yl)propan-2-ol
SMILESCCn1c(C(C)(C)O)cc2ccc(C)cc21
InChIInChI=1S/C14H19NO/c1-5-15-12-8-10(2)6-7-11(12)9-13(15)14(3,4)16/h6-9,16H,5H2,1-4H3
InChIKeySABCAYUQQGODJB-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.20
Rot. Bonds2

About 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol

2-(1-ethyl-6-methylindol-2-yl)propan-2-ol (PubChem CID 117122681) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1-ethyl-6-methylindol-2-yl)propan-2-ol
PubChem CID117122681
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2-(1-ethyl-6-methylindol-2-yl)propan-2-ol
SMILESCCn1c(C(C)(C)O)cc2ccc(C)cc21
InChIInChI=1S/C14H19NO/c1-5-15-12-8-10(2)6-7-11(12)9-13(15)14(3,4)16/h6-9,16H,5H2,1-4H3
InChIKeySABCAYUQQGODJB-UHFFFAOYSA-N
XLogP3.20
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-2-(2-hydroxypropan-2-yl)indol-4-ol
CID 117120545
1-(1-ethyl-6-methylindol-2-yl)ethanamine
CID 117122696
1-ethyl-2-(methoxymethyl)-6-methylindole
CID 117186050
2-(1-ethyl-6-hydroxyindol-2-yl)-2-methylpropanoic acid
CID 117122945
2-(4-bromo-1-ethylindol-2-yl)propan-2-ol
CID 117120397
1-ethyl-7-methyl-2-oxoquinoline-3-carbaldehyde
CID 18802182
2-(1-ethyl-4-methoxyindol-2-yl)propan-2-ol
CID 117120548
2-(2-aminopropan-2-yl)-1-ethylindol-5-ol
CID 117121687
[1-(1-ethyl-6-methylbenzimidazol-2-yl)-2,2-dimethylpropyl]carbamic acid
CID 67258730
1-(1-ethyl-5-methylbenzimidazol-2-yl)-1-(4-fluorophenyl)ethanol
CID 167614234
9-ethyl-2-methylcarbazole
CID 19788789
1-hydroxy-6-methylindol-2-ol
CID 123754216

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol?
The IUPAC name of 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol (CID 117122681) is 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol.
What is the SMILES notation for 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol?
The canonical SMILES for 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol is CCn1c(C(C)(C)O)cc2ccc(C)cc21.
What is the InChIKey of 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol?
The InChIKey is SABCAYUQQGODJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-5-15-12-8-10(2)6-7-11(12)9-13(15)14(3,4)16/h6-9,16H,5H2,1-4H3.
What are the key properties of 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol?
2-(1-ethyl-6-methylindol-2-yl)propan-2-ol has a molecular weight of 217.31 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethyl-6-methylindol-2-yl)propan-2-ol is sourced from PubChem (CID 117122681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).