2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol

C13H18O — CID 105444501

IUPAC2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol
SMILESCc1cccc2c1CC(C(C)CO)C2
InChIInChI=1S/C13H18O/c1-9-4-3-5-11-6-12(7-13(9)11)10(2)8-14/h3-5,10,12,14H,6-8H2,1-2H3
InChIKeyMVQFNTIDSGADTJ-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.34
Rot. Bonds2

About 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol

2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol (PubChem CID 105444501) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol
PubChem CID105444501
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol
SMILESCc1cccc2c1CC(C(C)CO)C2
InChIInChI=1S/C13H18O/c1-9-4-3-5-11-6-12(7-13(9)11)10(2)8-14/h3-5,10,12,14H,6-8H2,1-2H3
InChIKeyMVQFNTIDSGADTJ-UHFFFAOYSA-N
XLogP2.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol?
The IUPAC name of 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol (CID 105444501) is 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol.
What is the SMILES notation for 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol?
The canonical SMILES for 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol is Cc1cccc2c1CC(C(C)CO)C2.
What is the InChIKey of 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol?
The InChIKey is MVQFNTIDSGADTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O/c1-9-4-3-5-11-6-12(7-13(9)11)10(2)8-14/h3-5,10,12,14H,6-8H2,1-2H3.
What are the key properties of 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol?
2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol has a molecular weight of 190.29 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-2,3-dihydro-1H-inden-2-yl)propan-1-ol is sourced from PubChem (CID 105444501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).