3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol

C14H19NO — CID 76846717

IUPAC3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol
SMILESCC(C)c1cccc2c(CCCO)c[nH]c12
InChIInChI=1S/C14H19NO/c1-10(2)12-6-3-7-13-11(5-4-8-16)9-15-14(12)13/h3,6-7,9-10,15-16H,4-5,8H2,1-2H3
InChIKeyAIRDDNJWINKHIY-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.22
Rot. Bonds4

About 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol

3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol (PubChem CID 76846717) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol.

Molecular Properties

Compound Name3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol
PubChem CID76846717
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol
SMILESCC(C)c1cccc2c(CCCO)c[nH]c12
InChIInChI=1S/C14H19NO/c1-10(2)12-6-3-7-13-11(5-4-8-16)9-15-14(12)13/h3,6-7,9-10,15-16H,4-5,8H2,1-2H3
InChIKeyAIRDDNJWINKHIY-UHFFFAOYSA-N
XLogP3.22
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

16-(7-methoxy-1H-indol-3-yl)hexadecan-1-ol
CID 11429148
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3-(7-propan-2-yl-1H-indol-3-yl)butanoic acid
CID 76846716
3-butyl-7-fluoro-1H-indole
CID 106985261
1-(3-hydroxypropyl)-3-[2-(7-methyl-1H-indol-3-yl)ethyl]urea
CID 111507161
2-methyl-2-(7-propan-2-yl-1H-indol-3-yl)propanoic acid
CID 76847664
1,8-di(propan-2-yl)-9H-carbazole
CID 174295528
3-(7-ethoxy-1H-indol-3-yl)propan-1-amine
CID 82374015
ethyl 4-oxo-8-propan-2-yl-1H-quinoline-3-carboxylate
CID 735355
2-(7-methyl-1H-indol-3-yl)ethyl-propan-2-ylazanium
CID 170598949
2-(7-methyl-1H-indol-3-yl)ethyl-propan-2-ylazanium iodide
CID 170339447
3-naphthalen-1-ylpropan-1-ol
CID 14711518

Frequently Asked Questions

What is the IUPAC name of 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol?
The IUPAC name of 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol (CID 76846717) is 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol.
What is the SMILES notation for 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol?
The canonical SMILES for 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol is CC(C)c1cccc2c(CCCO)c[nH]c12.
What is the InChIKey of 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol?
The InChIKey is AIRDDNJWINKHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-10(2)12-6-3-7-13-11(5-4-8-16)9-15-14(12)13/h3,6-7,9-10,15-16H,4-5,8H2,1-2H3.
What are the key properties of 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol?
3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol has a molecular weight of 217.31 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-propan-2-yl-1H-indol-3-yl)propan-1-ol is sourced from PubChem (CID 76846717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).