2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide

C19H24N6O — CID 50984027

IUPAC2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide
SMILESCCn1nc(C)c(NC(=O)CN2CCc3c(cnc(C)c3C#N)C2)c1C
InChIInChI=1S/C19H24N6O/c1-5-25-14(4)19(13(3)23-25)22-18(26)11-24-7-6-16-15(10-24)9-21-12(2)17(16)8-20/h9H,5-7,10-11H2,1-4H3,(H,22,26)
InChIKeyPRAKSKBRJCJGDM-UHFFFAOYSA-N
MW352.44 g/mol
LogP2.09
Rot. Bonds4

About 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide

2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide (PubChem CID 50984027) has the molecular formula C19H24N6O and a molecular weight of 352.44 g/mol. Its IUPAC name is 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide
PubChem CID50984027
Molecular FormulaC19H24N6O
Molecular Weight352.44 g/mol
Exact Mass352.20
IUPAC Name2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide
SMILESCCn1nc(C)c(NC(=O)CN2CCc3c(cnc(C)c3C#N)C2)c1C
InChIInChI=1S/C19H24N6O/c1-5-25-14(4)19(13(3)23-25)22-18(26)11-24-7-6-16-15(10-24)9-21-12(2)17(16)8-20/h9H,5-7,10-11H2,1-4H3,(H,22,26)
InChIKeyPRAKSKBRJCJGDM-UHFFFAOYSA-N
XLogP2.09
TPSA86.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
CID 71866668
2-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide
CID 95851460
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)acetamide
CID 46977003
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(3S,4S)-3-hydroxy-4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 133135484
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(3S)-3-(pyridine-2-carbonyl)piperidin-1-yl]acetamide
CID 124752283
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[3-(pyridine-2-carbonyl)piperidin-1-yl]acetamide
CID 91832837
7-[[(1R,9aR)-1-hydroxy-2,3,4,6,7,8,9,9a-octahydroquinolizin-1-yl]methyl]-3-methyl-6,8-dihydro-5H-2,7-naphthyridine-4-carbonitrile
CID 46982960
2-amino-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide;hydrochloride
CID 130639181
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[3-(2-methylpiperidin-1-yl)azetidin-1-yl]acetamide
CID 91838166
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]acetamide
CID 91843220
N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-[(3S)-3-(1-methylbenzimidazol-2-yl)piperidin-1-yl]acetamide
CID 92626417
2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)-N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]acetamide
CID 38979073

Frequently Asked Questions

What is the IUPAC name of 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide?
The IUPAC name of 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide (CID 50984027) is 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide is CCn1nc(C)c(NC(=O)CN2CCc3c(cnc(C)c3C#N)C2)c1C.
What is the InChIKey of 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide?
The InChIKey is PRAKSKBRJCJGDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O/c1-5-25-14(4)19(13(3)23-25)22-18(26)11-24-7-6-16-15(10-24)9-21-12(2)17(16)8-20/h9H,5-7,10-11H2,1-4H3,(H,22,26).
What are the key properties of 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide?
2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide has a molecular weight of 352.44 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-cyano-6-methyl-3,4-dihydro-1H-2,7-naphthyridin-2-yl)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetamide is sourced from PubChem (CID 50984027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).