2-methylidene-6-propyloxan-4-ol

C9H16O2 — CID 59365110

IUPAC2-methylidene-6-propyloxan-4-ol
SMILESC=C1CC(O)CC(CCC)O1
InChIInChI=1S/C9H16O2/c1-3-4-9-6-8(10)5-7(2)11-9/h8-10H,2-6H2,1H3
InChIKeyFJWAWIWUKCDWCG-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.84
Rot. Bonds2

About 2-methylidene-6-propyloxan-4-ol

2-methylidene-6-propyloxan-4-ol (PubChem CID 59365110) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is 2-methylidene-6-propyloxan-4-ol.

Molecular Properties

Compound Name2-methylidene-6-propyloxan-4-ol
PubChem CID59365110
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name2-methylidene-6-propyloxan-4-ol
SMILESC=C1CC(O)CC(CCC)O1
InChIInChI=1S/C9H16O2/c1-3-4-9-6-8(10)5-7(2)11-9/h8-10H,2-6H2,1H3
InChIKeyFJWAWIWUKCDWCG-UHFFFAOYSA-N
XLogP1.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Undec-1-ene-4,6-diol
CID 68741265
(2S,4R,6S)-4-methoxy-2-methyl-6-prop-2-enyloxane
CID 11105800
(2R,4R)-4-[(4R)-dodec-1-en-4-yl]oxypentan-2-ol
CID 13072663
(2R,4R)-4-[(4S)-dodec-1-en-4-yl]oxypentan-2-ol
CID 13072664
(4S,6R)-undec-1-ene-4,6-diol
CID 16069546
(2S,6R)-2,6-bis(prop-2-enyl)oxan-4-ol
CID 101557863
(4R,10R)-10-methyl-2-methylideneoxecan-4-ol
CID 134859548
2-[(2R,4S,6R)-4-methoxy-6-prop-2-enyloxan-2-yl]ethanol
CID 145945203
4-(6-Methyl-4-methylene-3,4,5,6-tetrahydro-2H-pyran-2-yl)-1-butanol
CID 548899
(4S,6S)-undec-1-ene-4,6-diol
CID 101605778
7-(5-Hydroxyoct-1-en-2-yloxy)oct-7-en-4-ol
CID 20026795
7-Methoxy-3-methylideneoctan-1-ol
CID 22764429

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-6-propyloxan-4-ol?
The IUPAC name of 2-methylidene-6-propyloxan-4-ol (CID 59365110) is 2-methylidene-6-propyloxan-4-ol.
What is the SMILES notation for 2-methylidene-6-propyloxan-4-ol?
The canonical SMILES for 2-methylidene-6-propyloxan-4-ol is C=C1CC(O)CC(CCC)O1.
What is the InChIKey of 2-methylidene-6-propyloxan-4-ol?
The InChIKey is FJWAWIWUKCDWCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-3-4-9-6-8(10)5-7(2)11-9/h8-10H,2-6H2,1H3.
What are the key properties of 2-methylidene-6-propyloxan-4-ol?
2-methylidene-6-propyloxan-4-ol has a molecular weight of 156.22 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-6-propyloxan-4-ol is sourced from PubChem (CID 59365110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).