(2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one

C20H24O6 — CID 162826084

IUPAC(2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one
SMILESCC(C)(O)[C@H]1Cc2c(cc3oc(CO)cc(=O)c3c2OC2CCCC2)O1
InChIInChI=1S/C20H24O6/c1-20(2,23)17-8-13-15(26-17)9-16-18(14(22)7-12(10-21)24-16)19(13)25-11-5-3-4-6-11/h7,9,11,17,21,23H,3-6,8,10H2,1-2H3/t17-/m1/s1
InChIKeyKDGPOOXPFUCBJP-QGZVFWFLSA-N
MW360.41 g/mol
LogP2.68
Rot. Bonds4

About (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one

(2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one (PubChem CID 162826084) has the molecular formula C20H24O6 and a molecular weight of 360.41 g/mol. Its IUPAC name is (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one.

Molecular Properties

Compound Name(2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one
PubChem CID162826084
Molecular FormulaC20H24O6
Molecular Weight360.41 g/mol
Exact Mass360.16
IUPAC Name(2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one
SMILESCC(C)(O)[C@H]1Cc2c(cc3oc(CO)cc(=O)c3c2OC2CCCC2)O1
InChIInChI=1S/C20H24O6/c1-20(2,23)17-8-13-15(26-17)9-16-18(14(22)7-12(10-21)24-16)19(13)25-11-5-3-4-6-11/h7,9,11,17,21,23H,3-6,8,10H2,1-2H3/t17-/m1/s1
InChIKeyKDGPOOXPFUCBJP-QGZVFWFLSA-N
XLogP2.68
TPSA89.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one?
The IUPAC name of (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one (CID 162826084) is (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one.
What is the SMILES notation for (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one?
The canonical SMILES for (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one is CC(C)(O)[C@H]1Cc2c(cc3oc(CO)cc(=O)c3c2OC2CCCC2)O1.
What is the InChIKey of (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one?
The InChIKey is KDGPOOXPFUCBJP-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H24O6/c1-20(2,23)17-8-13-15(26-17)9-16-18(14(22)7-12(10-21)24-16)19(13)25-11-5-3-4-6-11/h7,9,11,17,21,23H,3-6,8,10H2,1-2H3/t17-/m1/s1.
What are the key properties of (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one?
(2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one has a molecular weight of 360.41 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-cyclopentyloxy-7-(hydroxymethyl)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-5-one is sourced from PubChem (CID 162826084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).