1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol

C11H20O3 — CID 107136247

IUPAC1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol
SMILESOC(C1CCCOC1)C1(O)CCCC1
InChIInChI=1S/C11H20O3/c12-10(9-4-3-7-14-8-9)11(13)5-1-2-6-11/h9-10,12-13H,1-8H2
InChIKeyXGVMGNMXQCGCTO-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.08
Rot. Bonds2

About 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol

1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol (PubChem CID 107136247) has the molecular formula C11H20O3 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol
PubChem CID107136247
Molecular FormulaC11H20O3
Molecular Weight200.28 g/mol
Exact Mass200.14
IUPAC Name1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol
SMILESOC(C1CCCOC1)C1(O)CCCC1
InChIInChI=1S/C11H20O3/c12-10(9-4-3-7-14-8-9)11(13)5-1-2-6-11/h9-10,12-13H,1-8H2
InChIKeyXGVMGNMXQCGCTO-UHFFFAOYSA-N
XLogP1.08
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1-methylcyclopropyl)-(oxan-3-yl)methanol
CID 107136175
1-[hydroxy(oxan-4-yl)methyl]cycloheptan-1-ol
CID 103452199
1-[cyclohexyl(hydroxy)methyl]cycloheptan-1-ol
CID 103451987
(2-methyloxolan-2-yl)-(oxan-3-yl)methanol
CID 107136169
(1-ethoxycyclopentyl)-(oxan-3-yl)methanol
CID 107136224
[1-(aminomethyl)-4,4-dimethylcyclohexyl]-(oxan-3-yl)methanol
CID 79138934
1-[1,9-dioxaspiro[5.5]undecan-4-yl(hydroxy)methyl]cyclohexan-1-ol
CID 103451663
[1-(aminomethyl)-3-methylcyclopentyl]-(oxan-3-yl)methanol
CID 79138103
[1-(aminomethyl)-4-ethylcyclohexyl]-(oxan-3-yl)methanol
CID 79138848
1-[hydroxy(oxolan-3-yl)methyl]cycloheptane-1-carbonitrile
CID 79136550
1-[hydroxy(oxolan-3-yl)methyl]cyclooctane-1-carbonitrile
CID 80603929
2-amino-1-(oxan-3-yl)butan-1-ol
CID 63737699

Frequently Asked Questions

What is the IUPAC name of 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol (CID 107136247) is 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol is OC(C1CCCOC1)C1(O)CCCC1.
What is the InChIKey of 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol?
The InChIKey is XGVMGNMXQCGCTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3/c12-10(9-4-3-7-14-8-9)11(13)5-1-2-6-11/h9-10,12-13H,1-8H2.
What are the key properties of 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol?
1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol has a molecular weight of 200.28 g/mol, XLogP of 1.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[hydroxy(oxan-3-yl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 107136247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).