3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol

C13H18O2 — CID 117294969

IUPAC3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol
SMILESCOc1cc2c(cc1CCCO)CCC2
InChIInChI=1S/C13H18O2/c1-15-13-9-11-5-2-4-10(11)8-12(13)6-3-7-14/h8-9,14H,2-7H2,1H3
InChIKeyWKOKISWYBKDEEK-UHFFFAOYSA-N
MW206.28 g/mol
LogP2.11
Rot. Bonds4

About 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol

3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol (PubChem CID 117294969) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol.

Molecular Properties

Compound Name3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol
PubChem CID117294969
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol
SMILESCOc1cc2c(cc1CCCO)CCC2
InChIInChI=1S/C13H18O2/c1-15-13-9-11-5-2-4-10(11)8-12(13)6-3-7-14/h8-9,14H,2-7H2,1H3
InChIKeyWKOKISWYBKDEEK-UHFFFAOYSA-N
XLogP2.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(6-methoxy-2,3-dihydro-1H-inden-5-yl)butanoic acid
CID 117340504
2-(6-methoxy-2,3-dihydro-1H-inden-5-yl)ethanesulfonyl chloride
CID 84713994
3-(4-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol
CID 117294953
2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol
CID 117289231
3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol
CID 117303114
1-(6-methoxy-2,3-dihydro-1H-inden-5-yl)butan-2-amine
CID 170890550
3-(4-ethyl-2-methoxy-5-methylsulfanylphenyl)propan-1-ol
CID 117353833
1-(3-methoxy-5,6,7,8-tetrahydronaphthalen-2-yl)-2-methylpropan-2-amine
CID 117339388
3-(5-ethyl-2-methoxyphenyl)propan-1-ol
CID 94680036
3-(6-methoxy-3,4-dihydro-2H-chromen-7-yl)-N,N-dimethylpropan-1-amine
CID 170865622
5-(5-chloro-2-methoxy-4-methylphenyl)pentan-1-ol
CID 98015509
3-(4-methoxythiophen-3-yl)propan-1-ol
CID 68749892

Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol?
The IUPAC name of 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol (CID 117294969) is 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol.
What is the SMILES notation for 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol?
The canonical SMILES for 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol is COc1cc2c(cc1CCCO)CCC2.
What is the InChIKey of 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol?
The InChIKey is WKOKISWYBKDEEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O2/c1-15-13-9-11-5-2-4-10(11)8-12(13)6-3-7-14/h8-9,14H,2-7H2,1H3.
What are the key properties of 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol?
3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol has a molecular weight of 206.28 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol is sourced from PubChem (CID 117294969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).