5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one

C10H18N2O2 — CID 105451618

IUPAC5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one
SMILESCC(CO)CN1NC(C2CC2)CC1=O
InChIInChI=1S/C10H18N2O2/c1-7(6-13)5-12-10(14)4-9(11-12)8-2-3-8/h7-9,11,13H,2-6H2,1H3
InChIKeyQRFJQSRMPSSWTR-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.13
Rot. Bonds4

About 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one

5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one (PubChem CID 105451618) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one.

Molecular Properties

Compound Name5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one
PubChem CID105451618
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one
SMILESCC(CO)CN1NC(C2CC2)CC1=O
InChIInChI=1S/C10H18N2O2/c1-7(6-13)5-12-10(14)4-9(11-12)8-2-3-8/h7-9,11,13H,2-6H2,1H3
InChIKeyQRFJQSRMPSSWTR-UHFFFAOYSA-N
XLogP0.13
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclobutyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one
CID 105466140
2-(3-hydroxy-2-methylpropyl)-5-methylpyrazolidin-3-one
CID 105435152
5-tert-butyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one
CID 105467971
5-cyclopropyl-2-(2-oxopropyl)pyrazolidin-3-one
CID 105440083
5-cyclohexyl-2-(2-hydroxyethyl)pyrazolidin-3-one
CID 105466158
5-cyclopentyl-2-(2-oxopropyl)pyrazolidin-3-one
CID 105464238
2-(3-hydroxy-2-methylpropyl)-5-methyl-1,2-oxazolidin-3-one
CID 105435464
5-ethyl-2-(2-hydroxypropyl)pyrazolidin-3-one
CID 105435164
4-amino-1-[(2R)-1-hydroxypropan-2-yl]pyrrolidin-2-one
CID 131038054
3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-2-methylpropan-1-ol
CID 102683276
3-cyclopentyl-6-cyclopropyl-1,3-diazinane-2,4-dione
CID 82002901
3-(cyclopropylamino)-1-(3-hydroxy-2-methylpropyl)pyrrolidin-2-one
CID 65035410

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one?
The IUPAC name of 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one (CID 105451618) is 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one.
What is the SMILES notation for 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one?
The canonical SMILES for 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one is CC(CO)CN1NC(C2CC2)CC1=O.
What is the InChIKey of 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one?
The InChIKey is QRFJQSRMPSSWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-7(6-13)5-12-10(14)4-9(11-12)8-2-3-8/h7-9,11,13H,2-6H2,1H3.
What are the key properties of 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one?
5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one has a molecular weight of 198.27 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2-(3-hydroxy-2-methylpropyl)pyrazolidin-3-one is sourced from PubChem (CID 105451618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).