4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile

C15H24N4 — CID 81060744

IUPAC4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile
SMILESCCN(CC)CC(C)Nc1cc(C)nc(C)c1C#N
InChIInChI=1S/C15H24N4/c1-6-19(7-2)10-12(4)18-15-8-11(3)17-13(5)14(15)9-16/h8,12H,6-7,10H2,1-5H3,(H,17,18)
InChIKeyHYPYKAUMTCIQAT-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.71
Rot. Bonds6

About 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile

4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile (PubChem CID 81060744) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile.

Molecular Properties

Compound Name4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile
PubChem CID81060744
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile
SMILESCCN(CC)CC(C)Nc1cc(C)nc(C)c1C#N
InChIInChI=1S/C15H24N4/c1-6-19(7-2)10-12(4)18-15-8-11(3)17-13(5)14(15)9-16/h8,12H,6-7,10H2,1-5H3,(H,17,18)
InChIKeyHYPYKAUMTCIQAT-UHFFFAOYSA-N
XLogP2.71
TPSA51.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dimethyl-4-(pentan-2-ylamino)pyridine-3-carbonitrile
CID 81061203
4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carboxylic acid
CID 81051442
2,6-dimethyl-4-(3-methylbutylamino)pyridine-3-carbonitrile
CID 81042476
4-(3,3-dimethylbutan-2-ylamino)-2,6-dimethylpyridine-3-carbonitrile
CID 104828350
1-N,7-N-bis[1-(diethylamino)propan-2-yl]-3,9-dimethylquinolino[8,7-h]quinoline-1,7-diamine;hydrochloride
CID 54607641
5-[(3-cyano-2,6-dimethyl-4-pyridinyl)amino]hexanoic acid
CID 82847005
4-[2-cyanopropyl(ethyl)amino]-2,6-dimethylpyridine-3-carbonitrile
CID 81060184
2,6-dimethyl-4-(1-pyridin-4-ylethylamino)pyridine-3-carbonitrile
CID 81060922
3-[(3-cyano-2,6-dimethyl-4-pyridinyl)amino]-N,N-diethylpropanamide
CID 81051927
2,6-dimethyl-4-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]pyridine-3-carbonitrile
CID 81061348
4-[ethyl(methyl)amino]-2,6-dimethylpyridine-3-carbonitrile
CID 81060716
4-(2,2-difluoroethylamino)-2,6-dimethylpyridine-3-carbonitrile
CID 115282671

Frequently Asked Questions

What is the IUPAC name of 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile?
The IUPAC name of 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile (CID 81060744) is 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile.
What is the SMILES notation for 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile?
The canonical SMILES for 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile is CCN(CC)CC(C)Nc1cc(C)nc(C)c1C#N.
What is the InChIKey of 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile?
The InChIKey is HYPYKAUMTCIQAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-6-19(7-2)10-12(4)18-15-8-11(3)17-13(5)14(15)9-16/h8,12H,6-7,10H2,1-5H3,(H,17,18).
What are the key properties of 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile?
4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile has a molecular weight of 260.38 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(diethylamino)propan-2-ylamino]-2,6-dimethylpyridine-3-carbonitrile is sourced from PubChem (CID 81060744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).