2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile

C11H16N4 — CID 62664814

IUPAC2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile
SMILESCCNCCNc1nc(C)ccc1C#N
InChIInChI=1S/C11H16N4/c1-3-13-6-7-14-11-10(8-12)5-4-9(2)15-11/h4-5,13H,3,6-7H2,1-2H3,(H,14,15)
InChIKeyYHYBYZIJAQLYJU-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.28
Rot. Bonds5

About 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile

2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile (PubChem CID 62664814) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile
PubChem CID62664814
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile
SMILESCCNCCNc1nc(C)ccc1C#N
InChIInChI=1S/C11H16N4/c1-3-13-6-7-14-11-10(8-12)5-4-9(2)15-11/h4-5,13H,3,6-7H2,1-2H3,(H,14,15)
InChIKeyYHYBYZIJAQLYJU-UHFFFAOYSA-N
XLogP1.28
TPSA60.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-methyl-2-[2-(propan-2-ylamino)ethylamino]pyridine-3-carbonitrile
CID 62663569
6-methyl-2-(octylamino)pyridine-3-carbonitrile
CID 113337282
6-methyl-2-(2-methylsulfanylethylamino)pyridine-3-carbonitrile
CID 63964127
2-(3-fluoropropylamino)-6-methylpyridine-3-carbonitrile
CID 130504273
2-(4-hydroxybutylamino)-6-methylpyridine-3-carbonitrile
CID 106842221
6-methyl-2-[2-(2-methylphenyl)ethylamino]pyridine-3-carbonitrile
CID 79749151
5-[(3-cyano-6-methyl-2-pyridinyl)amino]pentanamide
CID 106236909
6-methyl-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethylamino]pyridine-3-carbonitrile
CID 113343673
6-methyl-2-(2-thiophen-2-ylethylamino)pyridine-3-carbonitrile
CID 55207434
6-methyl-2-[3-(2-methylpropoxy)propylamino]pyridine-3-carbonitrile
CID 103801614
6-methyl-2-[2-(1,2,3,6-tetrahydropyridin-4-yl)ethylamino]pyridine-3-carbonitrile
CID 107488727
2-[(3-cyano-6-methyl-2-pyridinyl)amino]-N,N-diethylacetamide
CID 112548336

Frequently Asked Questions

What is the IUPAC name of 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile?
The IUPAC name of 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile (CID 62664814) is 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile?
The canonical SMILES for 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile is CCNCCNc1nc(C)ccc1C#N.
What is the InChIKey of 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile?
The InChIKey is YHYBYZIJAQLYJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-3-13-6-7-14-11-10(8-12)5-4-9(2)15-11/h4-5,13H,3,6-7H2,1-2H3,(H,14,15).
What are the key properties of 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile?
2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile has a molecular weight of 204.28 g/mol, XLogP of 1.28, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(ethylamino)ethylamino]-6-methylpyridine-3-carbonitrile is sourced from PubChem (CID 62664814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).