4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile

C15H22N4O — CID 60965079

IUPAC4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile
SMILESCc1cc(C)c(C#N)c(NC(C)CN2CCOCC2)n1
InChIInChI=1S/C15H22N4O/c1-11-8-12(2)17-15(14(11)9-16)18-13(3)10-19-4-6-20-7-5-19/h8,13H,4-7,10H2,1-3H3,(H,17,18)
InChIKeyYNACJLLOFUDKAN-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.70
Rot. Bonds4

About 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile

4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile (PubChem CID 60965079) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile.

Molecular Properties

Compound Name4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile
PubChem CID60965079
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile
SMILESCc1cc(C)c(C#N)c(NC(C)CN2CCOCC2)n1
InChIInChI=1S/C15H22N4O/c1-11-8-12(2)17-15(14(11)9-16)18-13(3)10-19-4-6-20-7-5-19/h8,13H,4-7,10H2,1-3H3,(H,17,18)
InChIKeyYNACJLLOFUDKAN-UHFFFAOYSA-N
XLogP1.70
TPSA61.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile?
The IUPAC name of 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile (CID 60965079) is 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile.
What is the SMILES notation for 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile?
The canonical SMILES for 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile is Cc1cc(C)c(C#N)c(NC(C)CN2CCOCC2)n1.
What is the InChIKey of 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile?
The InChIKey is YNACJLLOFUDKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-11-8-12(2)17-15(14(11)9-16)18-13(3)10-19-4-6-20-7-5-19/h8,13H,4-7,10H2,1-3H3,(H,17,18).
What are the key properties of 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile?
4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile has a molecular weight of 274.37 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile is sourced from PubChem (CID 60965079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).