4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol

C17H24O3 — CID 103158985

IUPAC4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol
SMILESOC(COc1cccc2c1CCC2O)CC1CCCC1
InChIInChI=1S/C17H24O3/c18-13(10-12-4-1-2-5-12)11-20-17-7-3-6-14-15(17)8-9-16(14)19/h3,6-7,12-13,16,18-19H,1-2,4-5,8-11H2
InChIKeyRKHBFEBJYHYHOI-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.99
Rot. Bonds5

About 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol

4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol (PubChem CID 103158985) has the molecular formula C17H24O3 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol
PubChem CID103158985
Molecular FormulaC17H24O3
Molecular Weight276.38 g/mol
Exact Mass276.17
IUPAC Name4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol
SMILESOC(COc1cccc2c1CCC2O)CC1CCCC1
InChIInChI=1S/C17H24O3/c18-13(10-12-4-1-2-5-12)11-20-17-7-3-6-14-15(17)8-9-16(14)19/h3,6-7,12-13,16,18-19H,1-2,4-5,8-11H2
InChIKeyRKHBFEBJYHYHOI-UHFFFAOYSA-N
XLogP2.99
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R)-4-(cyclopropylmethoxy)-2,3-dihydro-1H-inden-1-ol
CID 95012649
1-cyclopentyl-3-naphthalen-1-yloxypropan-2-ol
CID 103160605
5-(2,2-difluoroethoxy)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 65456544
1-cyclopentyl-3-(2-methoxyphenoxy)propan-2-ol
CID 103160603
4-[2-hydroxy-3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)propoxy]-2,3-dihydro-1H-inden-1-ol
CID 14750994
2-[(1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]acetonitrile
CID 63090888
1-cyclopentyl-3-[2-(1-hydroxypropyl)phenoxy]propan-2-ol
CID 103158943
4-[2-(2-hydroxyethoxy)ethoxy]-2,3-dihydro-1H-inden-1-ol
CID 55179905
4-but-3-ynoxy-2,3-dihydro-1H-inden-1-ol
CID 63091221
4-(3-phenylpropoxy)-2,3-dihydro-1H-inden-1-ol
CID 63091389
4-[[(1S,2R,4S)-4-chloro-2-hydroxycyclopentyl]methoxy]-2,3-dihydro-1H-inden-1-ol
CID 89299936
4-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)-2,3-dihydro-1H-inden-1-ol
CID 66419924

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol (CID 103158985) is 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol is OC(COc1cccc2c1CCC2O)CC1CCCC1.
What is the InChIKey of 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is RKHBFEBJYHYHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O3/c18-13(10-12-4-1-2-5-12)11-20-17-7-3-6-14-15(17)8-9-16(14)19/h3,6-7,12-13,16,18-19H,1-2,4-5,8-11H2.
What are the key properties of 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol?
4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 276.38 g/mol, XLogP of 2.99, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentyl-2-hydroxypropoxy)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 103158985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).