3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol

C12H20O2 — CID 115831607

IUPAC3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol
SMILESCC1(C(O)C2=COCCC2)CCCC1
InChIInChI=1S/C12H20O2/c1-12(6-2-3-7-12)11(13)10-5-4-8-14-9-10/h9,11,13H,2-8H2,1H3
InChIKeyWDGDVKBAMQMFFI-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.62
Rot. Bonds2

About 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol

3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol (PubChem CID 115831607) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol
PubChem CID115831607
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Name3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol
SMILESCC1(C(O)C2=COCCC2)CCCC1
InChIInChI=1S/C12H20O2/c1-12(6-2-3-7-12)11(13)10-5-4-8-14-9-10/h9,11,13H,2-8H2,1H3
InChIKeyWDGDVKBAMQMFFI-UHFFFAOYSA-N
XLogP2.62
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dihydro-2H-pyran-5-yl-[1-(2-methylpropyl)cyclopentyl]methanamine
CID 105033152
2-cyclobutyl-1-(3,4-dihydro-2H-pyran-5-yl)propan-1-ol
CID 164659731
3,4-dihydro-2H-pyran-5-yl-(5-methylpyrazin-2-yl)methanol
CID 105124479
1-(3,4-dihydro-2H-pyran-5-yl)-3-ethylsulfanylpropan-1-ol
CID 116504683
3,4-dihydro-2H-pyran-5-yl-(2-methyloxolan-3-yl)methanol
CID 115831448
[3,4-dihydro-2H-pyran-5-yl-(2-methylthiolan-2-yl)methyl]hydrazine
CID 105333259
3,4-dihydro-2H-chromen-6-yl-(1-methylcyclohexyl)methanol
CID 106828329
(5-chlorofuran-2-yl)-(3,4-dihydro-2H-pyran-5-yl)methanol
CID 106693982
(3-bromo-5-methylphenyl)-(3,4-dihydro-2H-pyran-5-yl)methanol
CID 115831444
3,4-dihydro-2H-pyran-5-yl-(1-ethoxy-4,4-dimethylcyclohexyl)methanamine
CID 116768695
1-(3,4-dihydro-2H-pyran-5-yl)-2,2-dimethylcyclobutan-1-ol
CID 130554979
3,4-dihydro-2H-pyran-5-yl-(2,6-dimethyl-3-pyridinyl)methanol
CID 105124497

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol?
The IUPAC name of 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol (CID 115831607) is 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol.
What is the SMILES notation for 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol?
The canonical SMILES for 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol is CC1(C(O)C2=COCCC2)CCCC1.
What is the InChIKey of 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol?
The InChIKey is WDGDVKBAMQMFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2/c1-12(6-2-3-7-12)11(13)10-5-4-8-14-9-10/h9,11,13H,2-8H2,1H3.
What are the key properties of 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol?
3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol has a molecular weight of 196.29 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-5-yl-(1-methylcyclopentyl)methanol is sourced from PubChem (CID 115831607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).