3-(5-ethyl-1-methylindol-3-yl)propan-1-ol

C14H19NO — CID 82278629

IUPAC3-(5-ethyl-1-methylindol-3-yl)propan-1-ol
SMILESCCc1ccc2c(c1)c(CCCO)cn2C
InChIInChI=1S/C14H19NO/c1-3-11-6-7-14-13(9-11)12(5-4-8-16)10-15(14)2/h6-7,9-10,16H,3-5,8H2,1-2H3
InChIKeyIXLIKJCZUVCJAK-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.67
Rot. Bonds4

About 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol

3-(5-ethyl-1-methylindol-3-yl)propan-1-ol (PubChem CID 82278629) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol.

Molecular Properties

Compound Name3-(5-ethyl-1-methylindol-3-yl)propan-1-ol
PubChem CID82278629
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name3-(5-ethyl-1-methylindol-3-yl)propan-1-ol
SMILESCCc1ccc2c(c1)c(CCCO)cn2C
InChIInChI=1S/C14H19NO/c1-3-11-6-7-14-13(9-11)12(5-4-8-16)10-15(14)2/h6-7,9-10,16H,3-5,8H2,1-2H3
InChIKeyIXLIKJCZUVCJAK-UHFFFAOYSA-N
XLogP2.67
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(5-ethyl-1-methylindol-3-yl)methanamine
CID 82490826
4-ethyl-N-[2-(5-ethyl-1-methylindol-3-yl)ethyl]-N-methylaniline
CID 122367887
5-ethyl-3-fluoro-1-methylindole;propane
CID 176701533
3-(5,6-diethoxy-1-methylindol-3-yl)propan-1-ol
CID 83944719
5-ethyl-1-methylindole-3-carboxylic acid
CID 82278766
3-(6-methoxy-1-methylindol-3-yl)propan-1-ol
CID 82278635
1-(5-ethyl-1-methylindol-3-yl)-2-methylpropan-1-one
CID 82278783
2-(5-ethoxy-1-methylindol-3-yl)ethanol
CID 82278619
2-[(5-ethyl-1-methylindol-3-yl)methyl]cyclopentan-1-one
CID 84635769
3-[3-(2-aminoethyl)-5-ethylindol-1-yl]propan-1-amine
CID 83948758
[3-(3-iodopropyl)-1-methylindol-5-yl]methanesulfonamide
CID 67808139
ethyl 3-butyl-1-methylindole-5-carboxylate
CID 21086101

Frequently Asked Questions

What is the IUPAC name of 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol?
The IUPAC name of 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol (CID 82278629) is 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol.
What is the SMILES notation for 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol?
The canonical SMILES for 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol is CCc1ccc2c(c1)c(CCCO)cn2C.
What is the InChIKey of 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol?
The InChIKey is IXLIKJCZUVCJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-3-11-6-7-14-13(9-11)12(5-4-8-16)10-15(14)2/h6-7,9-10,16H,3-5,8H2,1-2H3.
What are the key properties of 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol?
3-(5-ethyl-1-methylindol-3-yl)propan-1-ol has a molecular weight of 217.31 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethyl-1-methylindol-3-yl)propan-1-ol is sourced from PubChem (CID 82278629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).