1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol

C10H16N2O2 — CID 155547678

IUPAC1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol
SMILESOCC(O)c1cc(C2CCCC2)[nH]n1
InChIInChI=1S/C10H16N2O2/c13-6-10(14)9-5-8(11-12-9)7-3-1-2-4-7/h5,7,10,13-14H,1-4,6H2,(H,11,12)
InChIKeyRCIDONKBFZZHET-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.09
Rot. Bonds3

About 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol

1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol (PubChem CID 155547678) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol.

Molecular Properties

Compound Name1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol
PubChem CID155547678
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol
SMILESOCC(O)c1cc(C2CCCC2)[nH]n1
InChIInChI=1S/C10H16N2O2/c13-6-10(14)9-5-8(11-12-9)7-3-1-2-4-7/h5,7,10,13-14H,1-4,6H2,(H,11,12)
InChIKeyRCIDONKBFZZHET-UHFFFAOYSA-N
XLogP1.09
TPSA69.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol?
The IUPAC name of 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol (CID 155547678) is 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol.
What is the SMILES notation for 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol?
The canonical SMILES for 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol is OCC(O)c1cc(C2CCCC2)[nH]n1.
What is the InChIKey of 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol?
The InChIKey is RCIDONKBFZZHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c13-6-10(14)9-5-8(11-12-9)7-3-1-2-4-7/h5,7,10,13-14H,1-4,6H2,(H,11,12).
What are the key properties of 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol?
1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol has a molecular weight of 196.25 g/mol, XLogP of 1.09, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopentyl-1H-pyrazol-3-yl)ethane-1,2-diol is sourced from PubChem (CID 155547678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).