2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile

C15H26N6 — CID 46927197

IUPAC2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile
SMILESCc1cc(NCCN(C)C)nc(NCCN(C)C)c1C#N
InChIInChI=1S/C15H26N6/c1-12-10-14(17-6-8-20(2)3)19-15(13(12)11-16)18-7-9-21(4)5/h10H,6-9H2,1-5H3,(H2,17,18,19)
InChIKeyWVUXSCRQSCOOKV-UHFFFAOYSA-N
MW290.42 g/mol
LogP1.21
Rot. Bonds8

About 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile

2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile (PubChem CID 46927197) has the molecular formula C15H26N6 and a molecular weight of 290.42 g/mol. Its IUPAC name is 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile
PubChem CID46927197
Molecular FormulaC15H26N6
Molecular Weight290.42 g/mol
Exact Mass290.22
IUPAC Name2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile
SMILESCc1cc(NCCN(C)C)nc(NCCN(C)C)c1C#N
InChIInChI=1S/C15H26N6/c1-12-10-14(17-6-8-20(2)3)19-15(13(12)11-16)18-7-9-21(4)5/h10H,6-9H2,1-5H3,(H2,17,18,19)
InChIKeyWVUXSCRQSCOOKV-UHFFFAOYSA-N
XLogP1.21
TPSA67.22 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.42
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile?
The IUPAC name of 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile (CID 46927197) is 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile?
The canonical SMILES for 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile is Cc1cc(NCCN(C)C)nc(NCCN(C)C)c1C#N.
What is the InChIKey of 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile?
The InChIKey is WVUXSCRQSCOOKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N6/c1-12-10-14(17-6-8-20(2)3)19-15(13(12)11-16)18-7-9-21(4)5/h10H,6-9H2,1-5H3,(H2,17,18,19).
What are the key properties of 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile?
2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile has a molecular weight of 290.42 g/mol, XLogP of 1.21, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis[2-(dimethylamino)ethylamino]-4-methylpyridine-3-carbonitrile is sourced from PubChem (CID 46927197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).