2-(1,3-dimethylindol-7-yl)propan-2-ol

C13H17NO — CID 117205272

IUPAC2-(1,3-dimethylindol-7-yl)propan-2-ol
SMILESCc1cn(C)c2c(C(C)(C)O)cccc12
InChIInChI=1S/C13H17NO/c1-9-8-14(4)12-10(9)6-5-7-11(12)13(2,3)15/h5-8,15H,1-4H3
InChIKeyAASAKQBLKTYGEL-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.71
Rot. Bonds1

About 2-(1,3-dimethylindol-7-yl)propan-2-ol

2-(1,3-dimethylindol-7-yl)propan-2-ol (PubChem CID 117205272) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 2-(1,3-dimethylindol-7-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1,3-dimethylindol-7-yl)propan-2-ol
PubChem CID117205272
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name2-(1,3-dimethylindol-7-yl)propan-2-ol
SMILESCc1cn(C)c2c(C(C)(C)O)cccc12
InChIInChI=1S/C13H17NO/c1-9-8-14(4)12-10(9)6-5-7-11(12)13(2,3)15/h5-8,15H,1-4H3
InChIKeyAASAKQBLKTYGEL-UHFFFAOYSA-N
XLogP2.71
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 ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-methyl-7-(trifluoromethyl)indol-3-yl]propan-2-ol
CID 117197297
3,7-ditert-butyl-1-methylindole
CID 59882824
1,3-dimethylindol-7-amine
CID 83815699
2-(1,3-dimethylindol-4-yl)propan-2-ol
CID 15852030
CID 178005523
CID 178005523
2-(3-methyl-1H-indol-7-yl)propan-2-ol
CID 117205271
2-(2,3-dimethyl-1H-indol-7-yl)propan-2-ol
CID 117291884
2-[2-(chloromethyl)-3-methylphenyl]propan-2-ol
CID 57235930
2-(1,6,7-trimethylindol-3-yl)propan-2-amine
CID 83486241
3-[1-methyl-7-(trifluoromethyl)indol-3-yl]propanoic acid
CID 117197320
3-[1-methyl-7-(trifluoromethyl)indol-3-yl]propan-1-amine
CID 117197311
2-[4-(2-trimethylsilylethoxymethyl)-2,3-dihydro-1H-cyclopenta[b]indol-5-yl]propan-2-ol
CID 101254997

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dimethylindol-7-yl)propan-2-ol?
The IUPAC name of 2-(1,3-dimethylindol-7-yl)propan-2-ol (CID 117205272) is 2-(1,3-dimethylindol-7-yl)propan-2-ol.
What is the SMILES notation for 2-(1,3-dimethylindol-7-yl)propan-2-ol?
The canonical SMILES for 2-(1,3-dimethylindol-7-yl)propan-2-ol is Cc1cn(C)c2c(C(C)(C)O)cccc12.
What is the InChIKey of 2-(1,3-dimethylindol-7-yl)propan-2-ol?
The InChIKey is AASAKQBLKTYGEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-9-8-14(4)12-10(9)6-5-7-11(12)13(2,3)15/h5-8,15H,1-4H3.
What are the key properties of 2-(1,3-dimethylindol-7-yl)propan-2-ol?
2-(1,3-dimethylindol-7-yl)propan-2-ol has a molecular weight of 203.28 g/mol, XLogP of 2.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dimethylindol-7-yl)propan-2-ol is sourced from PubChem (CID 117205272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).