3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide

C14H20N4O — CID 103724912

IUPAC3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide
SMILESCNC(=O)C(C)CN(C)c1nc(C)cc(C)c1C#N
InChIInChI=1S/C14H20N4O/c1-9-6-11(3)17-13(12(9)7-15)18(5)8-10(2)14(19)16-4/h6,10H,8H2,1-5H3,(H,16,19)
InChIKeyHMTWLGNIZSWLIJ-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.39
Rot. Bonds4

About 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide

3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide (PubChem CID 103724912) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide
PubChem CID103724912
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide
SMILESCNC(=O)C(C)CN(C)c1nc(C)cc(C)c1C#N
InChIInChI=1S/C14H20N4O/c1-9-6-11(3)17-13(12(9)7-15)18(5)8-10(2)14(19)16-4/h6,10H,8H2,1-5H3,(H,16,19)
InChIKeyHMTWLGNIZSWLIJ-UHFFFAOYSA-N
XLogP1.39
TPSA69.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide?
The IUPAC name of 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide (CID 103724912) is 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide.
What is the SMILES notation for 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide?
The canonical SMILES for 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide is CNC(=O)C(C)CN(C)c1nc(C)cc(C)c1C#N.
What is the InChIKey of 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide?
The InChIKey is HMTWLGNIZSWLIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-9-6-11(3)17-13(12(9)7-15)18(5)8-10(2)14(19)16-4/h6,10H,8H2,1-5H3,(H,16,19).
What are the key properties of 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide?
3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide has a molecular weight of 260.34 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-cyano-4,6-dimethyl-2-pyridinyl)-methylamino]-N,2-dimethylpropanamide is sourced from PubChem (CID 103724912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).