(1-tert-butylindol-6-yl)methanol

C13H17NO — CID 161052286

IUPAC(1-tert-butylindol-6-yl)methanol
SMILESCC(C)(C)n1ccc2ccc(CO)cc21
InChIInChI=1S/C13H17NO/c1-13(2,3)14-7-6-11-5-4-10(9-15)8-12(11)14/h4-8,15H,9H2,1-3H3
InChIKeyUCHIFSWSYMXSAF-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.89
Rot. Bonds1

About (1-tert-butylindol-6-yl)methanol

(1-tert-butylindol-6-yl)methanol (PubChem CID 161052286) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is (1-tert-butylindol-6-yl)methanol.

Molecular Properties

Compound Name(1-tert-butylindol-6-yl)methanol
PubChem CID161052286
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name(1-tert-butylindol-6-yl)methanol
SMILESCC(C)(C)n1ccc2ccc(CO)cc21
InChIInChI=1S/C13H17NO/c1-13(2,3)14-7-6-11-5-4-10(9-15)8-12(11)14/h4-8,15H,9H2,1-3H3
InChIKeyUCHIFSWSYMXSAF-UHFFFAOYSA-N
XLogP2.89
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-tert-butylindol-6-yl)methanol?
The IUPAC name of (1-tert-butylindol-6-yl)methanol (CID 161052286) is (1-tert-butylindol-6-yl)methanol.
What is the SMILES notation for (1-tert-butylindol-6-yl)methanol?
The canonical SMILES for (1-tert-butylindol-6-yl)methanol is CC(C)(C)n1ccc2ccc(CO)cc21.
What is the InChIKey of (1-tert-butylindol-6-yl)methanol?
The InChIKey is UCHIFSWSYMXSAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-13(2,3)14-7-6-11-5-4-10(9-15)8-12(11)14/h4-8,15H,9H2,1-3H3.
What are the key properties of (1-tert-butylindol-6-yl)methanol?
(1-tert-butylindol-6-yl)methanol has a molecular weight of 203.28 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-tert-butylindol-6-yl)methanol is sourced from PubChem (CID 161052286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).