2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide

C14H19N5O2 — CID 9317365

IUPAC2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide
SMILESCc1nn(CN(C)CC(=O)NC2CC2)c(=O)c(C#N)c1C
InChIInChI=1S/C14H19N5O2/c1-9-10(2)17-19(14(21)12(9)6-15)8-18(3)7-13(20)16-11-4-5-11/h11H,4-5,7-8H2,1-3H3,(H,16,20)
InChIKeyYRWJTJCJJCEVOS-UHFFFAOYSA-N
MW289.34 g/mol
LogP-0.10
Rot. Bonds5

About 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide

2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide (PubChem CID 9317365) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide
PubChem CID9317365
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide
SMILESCc1nn(CN(C)CC(=O)NC2CC2)c(=O)c(C#N)c1C
InChIInChI=1S/C14H19N5O2/c1-9-10(2)17-19(14(21)12(9)6-15)8-18(3)7-13(20)16-11-4-5-11/h11H,4-5,7-8H2,1-3H3,(H,16,20)
InChIKeyYRWJTJCJJCEVOS-UHFFFAOYSA-N
XLogP-0.10
TPSA91.02 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide with MolForge

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Related Compounds

2-[cyanomethyl(methyl)amino]-N-cyclopropylacetamide
CID 60677002
2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)-N,N-dicyclohexylacetamide
CID 35300602
2-[[2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)acetyl]amino]-N-cyclopentylbenzamide
CID 24585036
N-cyclopropyl-2-[methyl-[(4-oxo-1,2,3-benzotriazin-3-yl)methyl]amino]acetamide
CID 9286183
2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)-N-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)acetamide
CID 18100982
2-(3,3-dimethyl-2-oxobutyl)-5,6-dimethyl-3-oxopyridazine-4-carbonitrile
CID 8537229
2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)-N-(2-cyanopropan-2-yl)-N-methylacetamide
CID 51099156
N-cyclopropyl-2-[methyl(prop-2-ynyl)amino]acetamide
CID 60670124
N-cyclopropyl-2-[(1,3-dimethylpyrazol-4-yl)methyl-methylamino]acetamide
CID 22196347
2-[[2-[[3-cyano-1-(4-fluorophenyl)-4,5-dimethylpyrrol-2-yl]amino]-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
CID 35802212
N-(2-chloro-4,6-dimethylphenyl)-2-(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)acetamide
CID 8538150
N-cyclopropyl-2-[[5-(3,4-dimethylphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl-methylamino]acetamide
CID 9286192

Frequently Asked Questions

What is the IUPAC name of 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide?
The IUPAC name of 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide (CID 9317365) is 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide is Cc1nn(CN(C)CC(=O)NC2CC2)c(=O)c(C#N)c1C.
What is the InChIKey of 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide?
The InChIKey is YRWJTJCJJCEVOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-9-10(2)17-19(14(21)12(9)6-15)8-18(3)7-13(20)16-11-4-5-11/h11H,4-5,7-8H2,1-3H3,(H,16,20).
What are the key properties of 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide?
2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide has a molecular weight of 289.34 g/mol, XLogP of -0.10, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl-methylamino]-N-cyclopropylacetamide is sourced from PubChem (CID 9317365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).