1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol

C10H20O3 — CID 58100206

IUPAC1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol
SMILESCCC(O)C1(C(O)CO)CCCC1
InChIInChI=1S/C10H20O3/c1-2-8(12)10(9(13)7-11)5-3-4-6-10/h8-9,11-13H,2-7H2,1H3
InChIKeyOJGYHCGGADNFNQ-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.67
Rot. Bonds4

About 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol

1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol (PubChem CID 58100206) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol.

Molecular Properties

Compound Name1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol
PubChem CID58100206
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol
SMILESCCC(O)C1(C(O)CO)CCCC1
InChIInChI=1S/C10H20O3/c1-2-8(12)10(9(13)7-11)5-3-4-6-10/h8-9,11-13H,2-7H2,1H3
InChIKeyOJGYHCGGADNFNQ-UHFFFAOYSA-N
XLogP0.67
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol?
The IUPAC name of 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol (CID 58100206) is 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol.
What is the SMILES notation for 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol?
The canonical SMILES for 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol is CCC(O)C1(C(O)CO)CCCC1.
What is the InChIKey of 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol?
The InChIKey is OJGYHCGGADNFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-2-8(12)10(9(13)7-11)5-3-4-6-10/h8-9,11-13H,2-7H2,1H3.
What are the key properties of 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol?
1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol has a molecular weight of 188.27 g/mol, XLogP of 0.67, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-hydroxypropyl)cyclopentyl]ethane-1,2-diol is sourced from PubChem (CID 58100206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).