1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one

C15H24N4O2 — CID 75504218

IUPAC1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one
SMILESCc1cc(N2CCC(NC(C)C3CCCO3)C2=O)n(C)n1
InChIInChI=1S/C15H24N4O2/c1-10-9-14(18(3)17-10)19-7-6-12(15(19)20)16-11(2)13-5-4-8-21-13/h9,11-13,16H,4-8H2,1-3H3
InChIKeyKPXORUPPROKSSE-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.99
Rot. Bonds4

About 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one

1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one (PubChem CID 75504218) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one
PubChem CID75504218
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one
SMILESCc1cc(N2CCC(NC(C)C3CCCO3)C2=O)n(C)n1
InChIInChI=1S/C15H24N4O2/c1-10-9-14(18(3)17-10)19-7-6-12(15(19)20)16-11(2)13-5-4-8-21-13/h9,11-13,16H,4-8H2,1-3H3
InChIKeyKPXORUPPROKSSE-UHFFFAOYSA-N
XLogP0.99
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(1-ethylpropyl)-3-methyl-1H-pyrazol-5-yl]tetrahydrofuran-2-carboxamide
CID 50967434
N1-(3-methyl-1-(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)-1H-pyrazol-5-yl)-N2-((tetrahydrofuran-2-yl)methyl)oxalamide
CID 135954051
N-[1-(1-ethylpropyl)-3-methyl-1H-pyrazol-5-yl]-2-(2-oxo-1,3-oxazolidin-3-yl)acetamide
CID 47000130
4-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)-N-(oxolan-2-ylmethyl)butanamide
CID 20928942
N-[(6S)-2,4-dimethyl-5-oxo-7,8-dihydro-6H-pyrazolo[1,5-a][1,3]diazepin-6-yl]-1-(oxolan-2-ylmethyl)-1,2,4-triazole-3-carboxamide
CID 124179240
6-amino-4-methyl-2-[2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethyl]-7,8-dihydro-6H-pyrazolo[1,5-a][1,3]diazepin-5-one
CID 124179833
6-amino-4-methyl-2-[2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethyl]-7,8-dihydro-6H-pyrazolo[1,5-a][1,3]diazepin-5-one;hydrochloride
CID 132167288
(6S)-6-amino-4-methyl-2-[2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)ethyl]-7,8-dihydro-6H-pyrazolo[1,5-a][1,3]diazepin-5-one
CID 163565028
4-(2-methyl-6,7-dihydro-5H-pyrazolo[1,5-a]pyrimidin-4-yl)-4-oxo-N-(oxolan-2-ylmethyl)butanamide
CID 20929157
(2S)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide
CID 35535492
(2R)-N-(2-cyclopentyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide
CID 35535497
(2S)-N-(2-ethyl-5-methylpyrazol-3-yl)oxolane-2-carboxamide
CID 35592596

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one?
The IUPAC name of 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one (CID 75504218) is 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one.
What is the SMILES notation for 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one?
The canonical SMILES for 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one is Cc1cc(N2CCC(NC(C)C3CCCO3)C2=O)n(C)n1.
What is the InChIKey of 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one?
The InChIKey is KPXORUPPROKSSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-10-9-14(18(3)17-10)19-7-6-12(15(19)20)16-11(2)13-5-4-8-21-13/h9,11-13,16H,4-8H2,1-3H3.
What are the key properties of 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one?
1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one has a molecular weight of 292.38 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylpyrazol-3-yl)-3-[1-(oxolan-2-yl)ethylamino]pyrrolidin-2-one is sourced from PubChem (CID 75504218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).