3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide

C12H14N6O — CID 154749790

IUPAC3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide
SMILESCN(C)c1cc(NC(=O)c2nccnc2N)ccn1
InChIInChI=1S/C12H14N6O/c1-18(2)9-7-8(3-4-14-9)17-12(19)10-11(13)16-6-5-15-10/h3-7H,1-2H3,(H2,13,16)(H,14,17,19)
InChIKeyIDWHTAFPCWAUCO-UHFFFAOYSA-N
MW258.29 g/mol
LogP0.77
Rot. Bonds3

About 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide

3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide (PubChem CID 154749790) has the molecular formula C12H14N6O and a molecular weight of 258.29 g/mol. Its IUPAC name is 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide
PubChem CID154749790
Molecular FormulaC12H14N6O
Molecular Weight258.29 g/mol
Exact Mass258.12
IUPAC Name3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide
SMILESCN(C)c1cc(NC(=O)c2nccnc2N)ccn1
InChIInChI=1S/C12H14N6O/c1-18(2)9-7-8(3-4-14-9)17-12(19)10-11(13)16-6-5-15-10/h3-7H,1-2H3,(H2,13,16)(H,14,17,19)
InChIKeyIDWHTAFPCWAUCO-UHFFFAOYSA-N
XLogP0.77
TPSA97.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.29
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2,6-dichloro-N-[2-(dimethylamino)-4-pyridinyl]benzamide
CID 59618587
3-amino-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 46673484
3-amino-N-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazine-2-carboxamide
CID 30136975
3-amino-N-(4-iodophenyl)pyrazine-2-carboxamide
CID 46525550
3-amino-N-[3-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methoxy]phenyl]pyrazine-2-carboxamide
CID 136525918
3-amino-N-[3-[[methyl-(2,2,2-trifluoroacetyl)amino]methyl]phenyl]pyrazine-2-carboxamide
CID 38587212
3-amino-N-[4-[cyclohexyl(methyl)carbamoyl]phenyl]pyrazine-2-carboxamide
CID 119132594
3-amino-N-(2-methyl-1,3-benzoxazol-6-yl)pyrazine-2-carboxamide
CID 86921862
3-amino-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]pyrazine-2-carboxamide
CID 38404382
3-amino-N-(3-methyl-4-pyridinyl)pyrazine-2-carboxamide
CID 136524322
3-amino-N-[3-(5-methyl-1,3-oxazol-2-yl)phenyl]pyrazine-2-carboxamide
CID 136524529
3-amino-N-(2-oxo-3H-1,3-benzoxazol-5-yl)pyrazine-2-carboxamide
CID 38467954

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide?
The IUPAC name of 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide (CID 154749790) is 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide?
The canonical SMILES for 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide is CN(C)c1cc(NC(=O)c2nccnc2N)ccn1.
What is the InChIKey of 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide?
The InChIKey is IDWHTAFPCWAUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O/c1-18(2)9-7-8(3-4-14-9)17-12(19)10-11(13)16-6-5-15-10/h3-7H,1-2H3,(H2,13,16)(H,14,17,19).
What are the key properties of 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide?
3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide has a molecular weight of 258.29 g/mol, XLogP of 0.77, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(dimethylamino)-4-pyridinyl]pyrazine-2-carboxamide is sourced from PubChem (CID 154749790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).