1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol

C13H18O2 — CID 79368775

IUPAC1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol
SMILESCCC(O)C1CCc2ccc(OC)cc21
InChIInChI=1S/C13H18O2/c1-3-13(14)11-7-5-9-4-6-10(15-2)8-12(9)11/h4,6,8,11,13-14H,3,5,7H2,1-2H3
InChIKeyHYGANYQHEFCFCA-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.50
Rot. Bonds3

About 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol

1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol (PubChem CID 79368775) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol.

Molecular Properties

Compound Name1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol
PubChem CID79368775
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol
SMILESCCC(O)C1CCc2ccc(OC)cc21
InChIInChI=1S/C13H18O2/c1-3-13(14)11-7-5-9-4-6-10(15-2)8-12(9)11/h4,6,8,11,13-14H,3,5,7H2,1-2H3
InChIKeyHYGANYQHEFCFCA-UHFFFAOYSA-N
XLogP2.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-amine
CID 79368390
N-ethyl-1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)ethanamine
CID 79368208
methyl 2-hydroxy-2-(6-methoxy-2,3-dihydro-1H-inden-1-yl)acetate
CID 79367554
1-(2,3-dihydro-1H-inden-1-yl)propan-1-ol
CID 18690782
methyl 2-(5-methoxy-2,3-dihydro-1H-inden-1-yl)butanoate
CID 23529443
6-methoxy-2,3-dihydro-1H-indene-1-thiol
CID 79374496
6-methoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 18627821
N-[1-(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]propan-1-amine
CID 79248643
N-(2-ethoxypropyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 113262166
(2R,3S)-3-hydroxy-1-[(1S)-6-methoxy-2,3-dihydro-1H-inden-1-yl]-2-methylbutan-1-one
CID 102574394
(2R)-2-[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]propan-1-ol
CID 114986964
1-(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-propylbutan-1-amine
CID 83050599

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol?
The IUPAC name of 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol (CID 79368775) is 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol.
What is the SMILES notation for 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol?
The canonical SMILES for 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol is CCC(O)C1CCc2ccc(OC)cc21.
What is the InChIKey of 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol?
The InChIKey is HYGANYQHEFCFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-3-13(14)11-7-5-9-4-6-10(15-2)8-12(9)11/h4,6,8,11,13-14H,3,5,7H2,1-2H3.
What are the key properties of 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol?
1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol has a molecular weight of 206.28 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)propan-1-ol is sourced from PubChem (CID 79368775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).