(4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol

C10H16O3 — CID 124706814

IUPAC(4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol
SMILESCc1ccc([C@](C)(O)CCCO)o1
InChIInChI=1S/C10H16O3/c1-8-4-5-9(13-8)10(2,12)6-3-7-11/h4-5,11-12H,3,6-7H2,1-2H3/t10-/m1/s1
InChIKeyUHTWIAWHVYTYFS-SNVBAGLBSA-N
MW184.23 g/mol
LogP1.57
Rot. Bonds4

About (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol

(4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol (PubChem CID 124706814) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol.

Molecular Properties

Compound Name(4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol
PubChem CID124706814
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name(4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol
SMILESCc1ccc([C@](C)(O)CCCO)o1
InChIInChI=1S/C10H16O3/c1-8-4-5-9(13-8)10(2,12)6-3-7-11/h4-5,11-12H,3,6-7H2,1-2H3/t10-/m1/s1
InChIKeyUHTWIAWHVYTYFS-SNVBAGLBSA-N
XLogP1.57
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol 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

2-Hydroxy-1-(4-(hydroxyethoxy)phenyl)-2-methyl-1-propanone
CID 86266
5-Methylfurfuryl alcohol
CID 520911
2,5-Furandimethanol
CID 74663
Bipinnatin J
CID 5470115
2-(1-Hydroxypropyl)furan
CID 33640
1-(2-Furyl)ethanol
CID 107243
[5-(Ethoxymethyl)furan-2-yl]methanol
CID 13793775
(1R,4R,5R)-3-Furan-3-yl-1,4,5-trihydroxy-cyclohex-2-enecarboxylic acid
CID 6483679
Kallolide A
CID 394352
(1R)-1-(furan-2-yl)ethan-1-ol
CID 642107
2-Furanmethanol, alpha-pentyl-
CID 85710
Ethyl 4-[5-(hydroxymethyl)furan-2-yl]benzoate
CID 900059

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol?
The IUPAC name of (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol (CID 124706814) is (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol.
What is the SMILES notation for (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol?
The canonical SMILES for (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol is Cc1ccc([C@](C)(O)CCCO)o1.
What is the InChIKey of (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol?
The InChIKey is UHTWIAWHVYTYFS-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H16O3/c1-8-4-5-9(13-8)10(2,12)6-3-7-11/h4-5,11-12H,3,6-7H2,1-2H3/t10-/m1/s1.
What are the key properties of (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol?
(4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol has a molecular weight of 184.23 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(5-methylfuran-2-yl)pentane-1,4-diol is sourced from PubChem (CID 124706814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).