3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide

C20H22N4O2 — CID 134703573

IUPAC3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide
SMILESCc1cccc(=O)n1CCC(=O)Nc1ccnn1C(C)c1ccccc1
InChIInChI=1S/C20H22N4O2/c1-15-7-6-10-20(26)23(15)14-12-19(25)22-18-11-13-21-24(18)16(2)17-8-4-3-5-9-17/h3-11,13,16H,12,14H2,1-2H3,(H,22,25)
InChIKeyUHOXBBLTVIMZII-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.99
Rot. Bonds6

About 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide

3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide (PubChem CID 134703573) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide.

Molecular Properties

Compound Name3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide
PubChem CID134703573
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide
SMILESCc1cccc(=O)n1CCC(=O)Nc1ccnn1C(C)c1ccccc1
InChIInChI=1S/C20H22N4O2/c1-15-7-6-10-20(26)23(15)14-12-19(25)22-18-11-13-21-24(18)16(2)17-8-4-3-5-9-17/h3-11,13,16H,12,14H2,1-2H3,(H,22,25)
InChIKeyUHOXBBLTVIMZII-UHFFFAOYSA-N
XLogP2.99
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-methylbenzimidazol-1-yl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide
CID 134706215
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CID 134707822
2-[3-(2-methyl-6-oxo-1-pyridinyl)propanoylamino]butanoic acid
CID 82031244
N-[4-(aminomethyl)phenyl]-3-(2-methyl-6-oxo-1-pyridinyl)propanamide
CID 82032029
1-(2-morpholin-4-ylethyl)-3-[2-[(1R)-1-phenylethyl]pyrazol-3-yl]urea
CID 97283704
3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)ethyl]propanamide
CID 118774071
1-(2-morpholin-4-ylethyl)-3-[2-(1-phenylethyl)pyrazol-3-yl]urea
CID 72924199
N-[3-oxo-3-[(2-propan-2-ylpyrazol-3-yl)amino]propyl]benzamide
CID 30181874
3-(2-methyl-6-oxo-1-pyridinyl)-N-[(2S)-1-(6-methyl-2-pyridinyl)propan-2-yl]propanamide
CID 126437741
2-(2-oxo-1-pyridinyl)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 47106513
3-(2-methyl-6-oxo-1-pyridinyl)-N-[(1S)-1-(3-methyl-2-pyridinyl)propyl]propanamide
CID 126441957
4-(2-methyl-6-oxo-1-pyridinyl)butanoic acid
CID 60875461

Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide?
The IUPAC name of 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide (CID 134703573) is 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide.
What is the SMILES notation for 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide?
The canonical SMILES for 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide is Cc1cccc(=O)n1CCC(=O)Nc1ccnn1C(C)c1ccccc1.
What is the InChIKey of 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide?
The InChIKey is UHOXBBLTVIMZII-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-15-7-6-10-20(26)23(15)14-12-19(25)22-18-11-13-21-24(18)16(2)17-8-4-3-5-9-17/h3-11,13,16H,12,14H2,1-2H3,(H,22,25).
What are the key properties of 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide?
3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide has a molecular weight of 350.42 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-6-oxo-1-pyridinyl)-N-[2-(1-phenylethyl)pyrazol-3-yl]propanamide is sourced from PubChem (CID 134703573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).