3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile

C10H14N4 — CID 106549278

IUPAC3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile
SMILESCCN(CCC#N)c1cc(C)cnn1
InChIInChI=1S/C10H14N4/c1-3-14(6-4-5-11)10-7-9(2)8-12-13-10/h7-8H,3-4,6H2,1-2H3
InChIKeyGCSBCAMKQUSURJ-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.52
Rot. Bonds4

About 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile

3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile (PubChem CID 106549278) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile.

Molecular Properties

Compound Name3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile
PubChem CID106549278
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile
SMILESCCN(CCC#N)c1cc(C)cnn1
InChIInChI=1S/C10H14N4/c1-3-14(6-4-5-11)10-7-9(2)8-12-13-10/h7-8H,3-4,6H2,1-2H3
InChIKeyGCSBCAMKQUSURJ-UHFFFAOYSA-N
XLogP1.52
TPSA52.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[ethyl-[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]propanenitrile
CID 80806847
3-[ethyl-(5-methylpyridazin-3-yl)amino]-2-methylpropanethioamide
CID 106549298
N-(2-bromoethyl)-N-butyl-5-methylpyridazin-3-amine
CID 106550679
methyl 4-[2-cyanoethyl(ethyl)amino]-6-methylpyrimidine-2-carboxylate
CID 66285395
3-[ethyl-(5-methylpyridazin-3-yl)amino]-N'-hydroxy-2-methylpropanimidamide
CID 106549390
3-[ethyl-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]propanenitrile
CID 80934943
3-[(5-bromo-1,3,4-thiadiazol-2-yl)-ethylamino]propanenitrile
CID 64624729
3-[(2-cyclopropyl-6-hydrazinylpyrimidin-4-yl)-ethylamino]propanenitrile
CID 80964347
3-[ethyl-(4-ethyl-1,3-thiazol-2-yl)amino]propanenitrile
CID 62961171
3-[ethyl-(6-methyl-5-nitro-2-pyridinyl)amino]propanenitrile
CID 80711760
3-[ethyl-[6-(ethylamino)-2-pyridinyl]amino]propanenitrile
CID 80806487
N'-(2-methoxyethyl)-N'-(5-methylpyridazin-3-yl)propane-1,3-diamine
CID 106549268

Frequently Asked Questions

What is the IUPAC name of 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile?
The IUPAC name of 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile (CID 106549278) is 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile.
What is the SMILES notation for 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile?
The canonical SMILES for 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile is CCN(CCC#N)c1cc(C)cnn1.
What is the InChIKey of 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile?
The InChIKey is GCSBCAMKQUSURJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-3-14(6-4-5-11)10-7-9(2)8-12-13-10/h7-8H,3-4,6H2,1-2H3.
What are the key properties of 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile?
3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile has a molecular weight of 190.25 g/mol, XLogP of 1.52, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl-(5-methylpyridazin-3-yl)amino]propanenitrile is sourced from PubChem (CID 106549278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).