2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide

C11H15N5O — CID 103102432

IUPAC2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide
SMILESCCN(CC(N)=O)c1nnc(C)c(C)c1C#N
InChIInChI=1S/C11H15N5O/c1-4-16(6-10(13)17)11-9(5-12)7(2)8(3)14-15-11/h4,6H2,1-3H3,(H2,13,17)
InChIKeyCBZYDBUAAPBKDG-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.28
Rot. Bonds4

About 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide

2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide (PubChem CID 103102432) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide.

Molecular Properties

Compound Name2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide
PubChem CID103102432
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide
SMILESCCN(CC(N)=O)c1nnc(C)c(C)c1C#N
InChIInChI=1S/C11H15N5O/c1-4-16(6-10(13)17)11-9(5-12)7(2)8(3)14-15-11/h4,6H2,1-3H3,(H2,13,17)
InChIKeyCBZYDBUAAPBKDG-UHFFFAOYSA-N
XLogP0.28
TPSA95.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5,6-Dimethyl-3-(4-methylpiperazin-1-yl)pyridazine-4-carbonitrile
CID 31535189
3-(4-Acetylpiperazin-1-yl)-5,6-dimethylpyridazine-4-carbonitrile
CID 31535262
5,6-Dimethyl-3-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]pyridazine-4-carbonitrile
CID 31536408
3-[2-(Azepan-1-yl)ethylamino]-5,6-dimethylpyridazine-4-carbonitrile
CID 32878096
3-[[(2S)-2-(diethylamino)-4-methylpentyl]amino]-5,6-dimethylpyridazine-4-carbonitrile
CID 36721664
5,6-Dimethyl-3-[4-(2-methylpropanoyl)piperazin-1-yl]pyridazine-4-carbonitrile
CID 45806877
5,6-Diethyl-3-[4-(4-methylpiperazin-1-yl)butylamino]pyridazine-4-carbonitrile
CID 75379455
1-(4-cyano-5,6-dimethylpyridazin-3-yl)-N-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 34060297
5,6-Dimethyl-3-[propyl(2,2,2-trifluoroethyl)amino]pyridazine-4-carbonitrile
CID 55008899
5,6-Dimethyl-3-[propan-2-yl(2,2,2-trifluoroethyl)amino]pyridazine-4-carbonitrile
CID 55009048
3-[Ethyl(2,2,2-trifluoroethyl)amino]-5,6-dimethylpyridazine-4-carbonitrile
CID 55009145
1-(4-cyano-5,6-dimethylpyridazin-3-yl)-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 56789590

Frequently Asked Questions

What is the IUPAC name of 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide?
The IUPAC name of 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide (CID 103102432) is 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide.
What is the SMILES notation for 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide?
The canonical SMILES for 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide is CCN(CC(N)=O)c1nnc(C)c(C)c1C#N.
What is the InChIKey of 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide?
The InChIKey is CBZYDBUAAPBKDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-4-16(6-10(13)17)11-9(5-12)7(2)8(3)14-15-11/h4,6H2,1-3H3,(H2,13,17).
What are the key properties of 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide?
2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide has a molecular weight of 233.27 g/mol, XLogP of 0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-cyano-5,6-dimethylpyridazin-3-yl)-ethylamino]acetamide is sourced from PubChem (CID 103102432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).