5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide

C13H14N4O3 — CID 95985082

IUPAC5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide
SMILESCN1C[C@H](NC(=O)c2cc(-c3ccco3)[nH]n2)CC1=O
InChIInChI=1S/C13H14N4O3/c1-17-7-8(5-12(17)18)14-13(19)10-6-9(15-16-10)11-3-2-4-20-11/h2-4,6,8H,5,7H2,1H3,(H,14,19)(H,15,16)/t8-/m1/s1
InChIKeyVYXWVKATBTXHIO-MRVPVSSYSA-N
MW274.28 g/mol
LogP0.63
Rot. Bonds3

About 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide

5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide (PubChem CID 95985082) has the molecular formula C13H14N4O3 and a molecular weight of 274.28 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide
PubChem CID95985082
Molecular FormulaC13H14N4O3
Molecular Weight274.28 g/mol
Exact Mass274.11
IUPAC Name5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide
SMILESCN1C[C@H](NC(=O)c2cc(-c3ccco3)[nH]n2)CC1=O
InChIInChI=1S/C13H14N4O3/c1-17-7-8(5-12(17)18)14-13(19)10-6-9(15-16-10)11-3-2-4-20-11/h2-4,6,8H,5,7H2,1H3,(H,14,19)(H,15,16)/t8-/m1/s1
InChIKeyVYXWVKATBTXHIO-MRVPVSSYSA-N
XLogP0.63
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide with MolForge

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Related Compounds

N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide
CID 110745997
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CID 167823705
5-(furan-2-yl)-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyrazole-3-carboxamide
CID 90633194
5-(furan-2-yl)-N-pentyl-1H-pyrazole-3-carboxamide
CID 25348232
N-tert-butyl-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 6626158
5-(furan-2-yl)-N-[(1R,2S)-2-phenylcyclopropyl]-1H-pyrazole-3-carboxamide
CID 167825291
5-(furan-2-yl)-N-[2-(methylamino)ethyl]-1H-pyrazole-3-carboxamide;hydrochloride
CID 119502872
N-(3-aminobutyl)-5-(furan-2-yl)-1H-pyrazole-3-carboxamide
CID 119498062
5-(furan-2-yl)-N-(1-thiophen-2-ylsulfonylpiperidin-4-yl)-1H-pyrazole-3-carboxamide
CID 167798179
5-(furan-2-yl)-N-(3-hydroxypropyl)-1H-pyrazole-3-carboxamide
CID 78854308
[(3R,5S)-3,5-dimethylpiperidin-1-yl]-[5-(furan-2-yl)-1H-pyrazol-3-yl]methanone
CID 35555894
5-(furan-2-yl)-N-prop-2-ynyl-1H-pyrazole-3-carboxamide
CID 25353049

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide (CID 95985082) is 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide is CN1C[C@H](NC(=O)c2cc(-c3ccco3)[nH]n2)CC1=O.
What is the InChIKey of 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide?
The InChIKey is VYXWVKATBTXHIO-MRVPVSSYSA-N. The full InChI is InChI=1S/C13H14N4O3/c1-17-7-8(5-12(17)18)14-13(19)10-6-9(15-16-10)11-3-2-4-20-11/h2-4,6,8H,5,7H2,1H3,(H,14,19)(H,15,16)/t8-/m1/s1.
What are the key properties of 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide?
5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide has a molecular weight of 274.28 g/mol, XLogP of 0.63, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 95985082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).