5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one

C16H20N4O3 — CID 136564527

IUPAC5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one
SMILESCOc1cc(=O)[nH]cc1C(=O)N1CCCC1c1cn(C)nc1C
InChIInChI=1S/C16H20N4O3/c1-10-12(9-19(2)18-10)13-5-4-6-20(13)16(22)11-8-17-15(21)7-14(11)23-3/h7-9,13H,4-6H2,1-3H3,(H,17,21)
InChIKeyIPRADYALLJSFSM-UHFFFAOYSA-N
MW316.36 g/mol
LogP1.40
Rot. Bonds3

About 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one

5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one (PubChem CID 136564527) has the molecular formula C16H20N4O3 and a molecular weight of 316.36 g/mol. Its IUPAC name is 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one
PubChem CID136564527
Molecular FormulaC16H20N4O3
Molecular Weight316.36 g/mol
Exact Mass316.15
IUPAC Name5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one
SMILESCOc1cc(=O)[nH]cc1C(=O)N1CCCC1c1cn(C)nc1C
InChIInChI=1S/C16H20N4O3/c1-10-12(9-19(2)18-10)13-5-4-6-20(13)16(22)11-8-17-15(21)7-14(11)23-3/h7-9,13H,4-6H2,1-3H3,(H,17,21)
InChIKeyIPRADYALLJSFSM-UHFFFAOYSA-N
XLogP1.40
TPSA80.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-3H-1,3-thiazol-2-one
CID 136538685
2-(2-chloro-6-methoxyphenyl)-1-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidin-1-yl]ethanone
CID 136531704
[2-(1,3-dimethylpyrazol-4-yl)pyrrolidin-1-yl]-(2,2-dioxo-3,4-dihydro-1H-pyrrolo[2,1-c][1,4]thiazin-8-yl)methanone
CID 166296334
[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-(1,3,6-trimethylpyrazolo[3,4-b]pyridin-4-yl)methanone
CID 46514691
4-methoxy-5-[4-(6-methyl-3-pyridinyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 138026932
(5-bromo-1H-indol-3-yl)-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]methanone
CID 45354604
N-[[4-[1-(1,3-dimethylpyrazole-4-carbonyl)pyrrolidin-2-yl]-2-pyridinyl]methyl]acetamide
CID 110095748
[2-(2-methoxyphenyl)pyrrolidin-1-yl]-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-yl)methanone
CID 50983477
(2-methoxyphenyl)-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]methanone
CID 110873124
1,6-dimethyl-3-[(2R)-2-(1,3,5-trimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]pyridin-2-one
CID 95735764
[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-[3-(1,3,5-trimethylpyrazol-4-yl)-1H-pyrazol-5-yl]methanone
CID 78879259
4-methoxy-5-[3-(trifluoromethyl)morpholine-4-carbonyl]-1H-pyridin-2-one
CID 167924843

Frequently Asked Questions

What is the IUPAC name of 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one?
The IUPAC name of 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one (CID 136564527) is 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one.
What is the SMILES notation for 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one?
The canonical SMILES for 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one is COc1cc(=O)[nH]cc1C(=O)N1CCCC1c1cn(C)nc1C.
What is the InChIKey of 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one?
The InChIKey is IPRADYALLJSFSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O3/c1-10-12(9-19(2)18-10)13-5-4-6-20(13)16(22)11-8-17-15(21)7-14(11)23-3/h7-9,13H,4-6H2,1-3H3,(H,17,21).
What are the key properties of 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one?
5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one has a molecular weight of 316.36 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(1,3-dimethylpyrazol-4-yl)pyrrolidine-1-carbonyl]-4-methoxy-1H-pyridin-2-one is sourced from PubChem (CID 136564527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).