N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide

C17H24N4O2 — CID 95120648

IUPACN-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
SMILESCc1cc(C)n([C@H](C)CNC(=O)c2c(C)cc(C)n(C)c2=O)n1
InChIInChI=1S/C17H24N4O2/c1-10-7-12(3)20(6)17(23)15(10)16(22)18-9-14(5)21-13(4)8-11(2)19-21/h7-8,14H,9H2,1-6H3,(H,18,22)/t14-/m1/s1
InChIKeyGLFLRPYTDUFPIH-CQSZACIVSA-N
MW316.41 g/mol
LogP1.81
Rot. Bonds4

About N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide

N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide (PubChem CID 95120648) has the molecular formula C17H24N4O2 and a molecular weight of 316.41 g/mol. Its IUPAC name is N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
PubChem CID95120648
Molecular FormulaC17H24N4O2
Molecular Weight316.41 g/mol
Exact Mass316.19
IUPAC NameN-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
SMILESCc1cc(C)n([C@H](C)CNC(=O)c2c(C)cc(C)n(C)c2=O)n1
InChIInChI=1S/C17H24N4O2/c1-10-7-12(3)20(6)17(23)15(10)16(22)18-9-14(5)21-13(4)8-11(2)19-21/h7-8,14H,9H2,1-6H3,(H,18,22)/t14-/m1/s1
InChIKeyGLFLRPYTDUFPIH-CQSZACIVSA-N
XLogP1.81
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]benzamide
CID 7444930
N-[2-(3,5-dimethylpyrazol-1-yl)propyl]-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
CID 74246934
6-chloro-N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1-methylindole-2-carboxamide
CID 99949687
N-[2-(3,5-dimethylpyrazol-1-yl)propyl]-2-oxo-6-phenyl-1H-pyridine-3-carboxamide
CID 72873095
N-[2-(3,5-dimethylpyrazol-1-yl)propyl]-5-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 74238597
N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]-2-(methylamino)pyridine-4-carboxamide
CID 92603054
N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxamide
CID 95123695
3-(3,5-dimethylpyrazol-1-yl)butanamide
CID 130652830
N-(2-methoxy-2-thiophen-2-ylethyl)-1,4,6-trimethyl-2-oxopyridine-3-carboxamide
CID 50959243
N-[(2S)-2-(3,5-dimethylpyrazol-1-yl)propyl]-2-(4,6,7-trimethyl-1-benzofuran-3-yl)acetamide
CID 99929818
N-[2-(3,5-dimethylpyrazol-1-yl)propyl]-5-(morpholin-4-ylmethyl)furan-3-carboxamide
CID 74237864
N-[2-(3,5-dimethylpyrazol-1-yl)propyl]-3-pyridin-4-ylpropanamide
CID 74234825

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The IUPAC name of N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide (CID 95120648) is N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide is Cc1cc(C)n([C@H](C)CNC(=O)c2c(C)cc(C)n(C)c2=O)n1.
What is the InChIKey of N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
The InChIKey is GLFLRPYTDUFPIH-CQSZACIVSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-10-7-12(3)20(6)17(23)15(10)16(22)18-9-14(5)21-13(4)8-11(2)19-21/h7-8,14H,9H2,1-6H3,(H,18,22)/t14-/m1/s1.
What are the key properties of N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide?
N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide has a molecular weight of 316.41 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propyl]-1,4,6-trimethyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 95120648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).