2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide

C12H12N4O — CID 53318613

IUPAC2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide
SMILESCc1cc(-c2cnc(N)c(C(N)=O)c2)ccn1
InChIInChI=1S/C12H12N4O/c1-7-4-8(2-3-15-7)9-5-10(12(14)17)11(13)16-6-9/h2-6H,1H3,(H2,13,16)(H2,14,17)
InChIKeyOGOZUAZRHLCAFI-UHFFFAOYSA-N
MW228.25 g/mol
LogP1.13
Rot. Bonds2

About 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide

2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide (PubChem CID 53318613) has the molecular formula C12H12N4O and a molecular weight of 228.25 g/mol. Its IUPAC name is 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide
PubChem CID53318613
Molecular FormulaC12H12N4O
Molecular Weight228.25 g/mol
Exact Mass228.10
IUPAC Name2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide
SMILESCc1cc(-c2cnc(N)c(C(N)=O)c2)ccn1
InChIInChI=1S/C12H12N4O/c1-7-4-8(2-3-15-7)9-5-10(12(14)17)11(13)16-6-9/h2-6H,1H3,(H2,13,16)(H2,14,17)
InChIKeyOGOZUAZRHLCAFI-UHFFFAOYSA-N
XLogP1.13
TPSA94.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide (CID 53318613) is 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide is Cc1cc(-c2cnc(N)c(C(N)=O)c2)ccn1.
What is the InChIKey of 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide?
The InChIKey is OGOZUAZRHLCAFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O/c1-7-4-8(2-3-15-7)9-5-10(12(14)17)11(13)16-6-9/h2-6H,1H3,(H2,13,16)(H2,14,17).
What are the key properties of 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide?
2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide has a molecular weight of 228.25 g/mol, XLogP of 1.13, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2-methyl-4-pyridinyl)pyridine-3-carboxamide is sourced from PubChem (CID 53318613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).