5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one

C11H16N2O2 — CID 66021927

IUPAC5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one
SMILESO=c1cc(C2CC2)[nH]n1C1CCCC1O
InChIInChI=1S/C11H16N2O2/c14-10-3-1-2-9(10)13-11(15)6-8(12-13)7-4-5-7/h6-7,9-10,12,14H,1-5H2
InChIKeyFNMDCGSFDWPMKB-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.14
Rot. Bonds2

About 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one

5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one (PubChem CID 66021927) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one.

Molecular Properties

Compound Name5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one
PubChem CID66021927
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one
SMILESO=c1cc(C2CC2)[nH]n1C1CCCC1O
InChIInChI=1S/C11H16N2O2/c14-10-3-1-2-9(10)13-11(15)6-8(12-13)7-4-5-7/h6-7,9-10,12,14H,1-5H2
InChIKeyFNMDCGSFDWPMKB-UHFFFAOYSA-N
XLogP1.14
TPSA58.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one?
The IUPAC name of 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one (CID 66021927) is 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one.
What is the SMILES notation for 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one?
The canonical SMILES for 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one is O=c1cc(C2CC2)[nH]n1C1CCCC1O.
What is the InChIKey of 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one?
The InChIKey is FNMDCGSFDWPMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c14-10-3-1-2-9(10)13-11(15)6-8(12-13)7-4-5-7/h6-7,9-10,12,14H,1-5H2.
What are the key properties of 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one?
5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one has a molecular weight of 208.26 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-(2-hydroxycyclopentyl)-1H-pyrazol-3-one is sourced from PubChem (CID 66021927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).