1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol

C13H15NO — CID 117290218

IUPAC1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol
SMILESCc1cn(C)c2ccc(C3(O)CC3)cc12
InChIInChI=1S/C13H15NO/c1-9-8-14(2)12-4-3-10(7-11(9)12)13(15)5-6-13/h3-4,7-8,15H,5-6H2,1-2H3
InChIKeyNFPFXOKBDJQZIL-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.47
Rot. Bonds1

About 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol

1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol (PubChem CID 117290218) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol
PubChem CID117290218
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol
SMILESCc1cn(C)c2ccc(C3(O)CC3)cc12
InChIInChI=1S/C13H15NO/c1-9-8-14(2)12-4-3-10(7-11(9)12)13(15)5-6-13/h3-4,7-8,15H,5-6H2,1-2H3
InChIKeyNFPFXOKBDJQZIL-UHFFFAOYSA-N
XLogP2.47
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol?
The IUPAC name of 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol (CID 117290218) is 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol.
What is the SMILES notation for 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol?
The canonical SMILES for 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol is Cc1cn(C)c2ccc(C3(O)CC3)cc12.
What is the InChIKey of 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol?
The InChIKey is NFPFXOKBDJQZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-9-8-14(2)12-4-3-10(7-11(9)12)13(15)5-6-13/h3-4,7-8,15H,5-6H2,1-2H3.
What are the key properties of 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol?
1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol has a molecular weight of 201.27 g/mol, XLogP of 2.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethylindol-5-yl)cyclopropan-1-ol is sourced from PubChem (CID 117290218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).