1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol

C13H16O — CID 117281201

IUPAC1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol
SMILESCC1CCc2ccc(C3(O)CC3)cc21
InChIInChI=1S/C13H16O/c1-9-2-3-10-4-5-11(8-12(9)10)13(14)6-7-13/h4-5,8-9,14H,2-3,6-7H2,1H3
InChIKeyFLFUWEAQNYUWQQ-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.72
Rot. Bonds1

About 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol

1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol (PubChem CID 117281201) has the molecular formula C13H16O and a molecular weight of 188.27 g/mol. Its IUPAC name is 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol
PubChem CID117281201
Molecular FormulaC13H16O
Molecular Weight188.27 g/mol
Exact Mass188.12
IUPAC Name1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol
SMILESCC1CCc2ccc(C3(O)CC3)cc21
InChIInChI=1S/C13H16O/c1-9-2-3-10-4-5-11(8-12(9)10)13(14)6-7-13/h4-5,8-9,14H,2-3,6-7H2,1H3
InChIKeyFLFUWEAQNYUWQQ-UHFFFAOYSA-N
XLogP2.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol?
The IUPAC name of 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol (CID 117281201) is 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol.
What is the SMILES notation for 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol?
The canonical SMILES for 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol is CC1CCc2ccc(C3(O)CC3)cc21.
What is the InChIKey of 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol?
The InChIKey is FLFUWEAQNYUWQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O/c1-9-2-3-10-4-5-11(8-12(9)10)13(14)6-7-13/h4-5,8-9,14H,2-3,6-7H2,1H3.
What are the key properties of 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol?
1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol has a molecular weight of 188.27 g/mol, XLogP of 2.72, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2,3-dihydro-1H-inden-5-yl)cyclopropan-1-ol is sourced from PubChem (CID 117281201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).