1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol

C10H20O3 — CID 69080756

IUPAC1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol
SMILESCOCCC(O)C1(O)CCCCC1
InChIInChI=1S/C10H20O3/c1-13-8-5-9(11)10(12)6-3-2-4-7-10/h9,11-12H,2-8H2,1H3
InChIKeyYUISHPNHBMIPDW-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.08
Rot. Bonds4

About 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol

1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol (PubChem CID 69080756) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol
PubChem CID69080756
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol
SMILESCOCCC(O)C1(O)CCCCC1
InChIInChI=1S/C10H20O3/c1-13-8-5-9(11)10(12)6-3-2-4-7-10/h9,11-12H,2-8H2,1H3
InChIKeyYUISHPNHBMIPDW-UHFFFAOYSA-N
XLogP1.08
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-hydroxy-4-methylpentyl)cyclohexan-1-ol
CID 103451630
1-(1-hydroxydodecyl)cyclohexan-1-ol
CID 23056048
1-(1-hydroxytridecyl)cyclohexan-1-ol
CID 103451628
1-(1-hydroxyoct-7-enyl)cycloheptan-1-ol
CID 107008754
1-(3-cyclopropyl-1-hydroxypropyl)cycloheptan-1-ol
CID 103452170
4-methoxy-1-[1-(2-methylpropyl)cyclopentyl]butan-1-ol
CID 115839615
1-(4,4,4-trifluoro-1-hydroxybutyl)cyclopentan-1-ol
CID 103448224
4-methoxy-1-(2-methyloxan-2-yl)butan-1-ol
CID 114854964
1-[(4-methoxybutan-2-ylamino)methyl]cycloheptan-1-ol
CID 64604658
[1-(4-methoxybutan-2-yl)cyclobutyl]methanol
CID 116500225
1-(chloromethyl)-1-(4-methoxybutan-2-yl)cyclopentane
CID 116500273
1-(2-hydroxy-1-methoxypropyl)cyclohexan-1-ol
CID 67782644

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol?
The IUPAC name of 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol (CID 69080756) is 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol?
The canonical SMILES for 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol is COCCC(O)C1(O)CCCCC1.
What is the InChIKey of 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol?
The InChIKey is YUISHPNHBMIPDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-13-8-5-9(11)10(12)6-3-2-4-7-10/h9,11-12H,2-8H2,1H3.
What are the key properties of 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol?
1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol has a molecular weight of 188.27 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydroxy-3-methoxypropyl)cyclohexan-1-ol is sourced from PubChem (CID 69080756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).