(2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol

C9H16O2 — CID 131983561

IUPAC(2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol
SMILESCCCC1CCC(CO)=CO1
InChIInChI=1S/C9H16O2/c1-2-3-9-5-4-8(6-10)7-11-9/h7,9-10H,2-6H2,1H3
InChIKeyHFOFMOHAHHJJBO-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.84
Rot. Bonds3

About (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol

(2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol (PubChem CID 131983561) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol.

Molecular Properties

Compound Name(2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol
PubChem CID131983561
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name(2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol
SMILESCCCC1CCC(CO)=CO1
InChIInChI=1S/C9H16O2/c1-2-3-9-5-4-8(6-10)7-11-9/h7,9-10H,2-6H2,1H3
InChIKeyHFOFMOHAHHJJBO-UHFFFAOYSA-N
XLogP1.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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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Frequently Asked Questions

What is the IUPAC name of (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol?
The IUPAC name of (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol (CID 131983561) is (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol.
What is the SMILES notation for (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol?
The canonical SMILES for (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol is CCCC1CCC(CO)=CO1.
What is the InChIKey of (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol?
The InChIKey is HFOFMOHAHHJJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O2/c1-2-3-9-5-4-8(6-10)7-11-9/h7,9-10H,2-6H2,1H3.
What are the key properties of (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol?
(2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol has a molecular weight of 156.22 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propyl-3,4-dihydro-2H-pyran-5-yl)methanol is sourced from PubChem (CID 131983561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).