1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile

C11H15N3O — CID 82146932

IUPAC1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile
SMILESCc1ccc(C#N)c(=O)n1CC(C)(C)N
InChIInChI=1S/C11H15N3O/c1-8-4-5-9(6-12)10(15)14(8)7-11(2,3)13/h4-5H,7,13H2,1-3H3
InChIKeyMUZNSJNENZFBRK-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.77
Rot. Bonds2

About 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile

1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile (PubChem CID 82146932) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile.

Molecular Properties

Compound Name1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile
PubChem CID82146932
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile
SMILESCc1ccc(C#N)c(=O)n1CC(C)(C)N
InChIInChI=1S/C11H15N3O/c1-8-4-5-9(6-12)10(15)14(8)7-11(2,3)13/h4-5H,7,13H2,1-3H3
InChIKeyMUZNSJNENZFBRK-UHFFFAOYSA-N
XLogP0.77
TPSA71.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-1-(3-methylbut-2-enyl)-2-oxopyridine-3-carbonitrile
CID 107072857
6-methyl-2-oxo-1-(3-sulfanylpropyl)pyridine-3-carbonitrile
CID 130561478
1-[(4-chlorophenyl)methyl]-6-methyl-2-oxopyridine-3-carbonitrile
CID 82099441
1-[3-(dimethylamino)propyl]-6-methyl-2-oxopyridine-3-carbonitrile
CID 82099513
2-(3-cyano-6-methyl-2-oxo-1-pyridinyl)-N-methylacetamide
CID 82099506
6-methyl-1-(3-methylsulfanylpropyl)-2-oxopyridine-3-carbonitrile
CID 107072997
5-(3-cyano-6-methyl-2-oxo-1-pyridinyl)pentanoic acid
CID 82147473
6-methyl-1-(2-methylpentyl)-2-oxopyridine-3-carbonitrile
CID 107072821
1-[(2,6-difluorophenyl)methyl]-6-methyl-2-oxopyridine-3-carbonitrile
CID 107072777
1-[(Z)-3-chloro-2-methylprop-2-enyl]-6-methyl-2-oxopyridine-3-carbonitrile
CID 106439931
1-[(2-cyano-4-pyridinyl)methyl]-6-methyl-2-oxopyridine-3-carbonitrile
CID 107072766
2-(3-cyano-6-methyl-2-oxo-1-pyridinyl)-N,N-diethylacetamide
CID 82099388

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile?
The IUPAC name of 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile (CID 82146932) is 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile.
What is the SMILES notation for 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile?
The canonical SMILES for 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile is Cc1ccc(C#N)c(=O)n1CC(C)(C)N.
What is the InChIKey of 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile?
The InChIKey is MUZNSJNENZFBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8-4-5-9(6-12)10(15)14(8)7-11(2,3)13/h4-5H,7,13H2,1-3H3.
What are the key properties of 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile?
1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile has a molecular weight of 205.26 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-methylpropyl)-6-methyl-2-oxopyridine-3-carbonitrile is sourced from PubChem (CID 82146932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).