5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide

C14H13N5O — CID 114406485

IUPAC5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide
SMILESCN(c1ccc(C#N)cc1)c1nc(C(N)=O)ccc1N
InChIInChI=1S/C14H13N5O/c1-19(10-4-2-9(8-15)3-5-10)14-11(16)6-7-12(18-14)13(17)20/h2-7H,16H2,1H3,(H2,17,20)
InChIKeyCEKCFBPMLOMJBO-UHFFFAOYSA-N
MW267.29 g/mol
LogP1.40
Rot. Bonds3

About 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide

5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide (PubChem CID 114406485) has the molecular formula C14H13N5O and a molecular weight of 267.29 g/mol. Its IUPAC name is 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide
PubChem CID114406485
Molecular FormulaC14H13N5O
Molecular Weight267.29 g/mol
Exact Mass267.11
IUPAC Name5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide
SMILESCN(c1ccc(C#N)cc1)c1nc(C(N)=O)ccc1N
InChIInChI=1S/C14H13N5O/c1-19(10-4-2-9(8-15)3-5-10)14-11(16)6-7-12(18-14)13(17)20/h2-7H,16H2,1H3,(H2,17,20)
InChIKeyCEKCFBPMLOMJBO-UHFFFAOYSA-N
XLogP1.40
TPSA109.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide?
The IUPAC name of 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide (CID 114406485) is 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide is CN(c1ccc(C#N)cc1)c1nc(C(N)=O)ccc1N.
What is the InChIKey of 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide?
The InChIKey is CEKCFBPMLOMJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O/c1-19(10-4-2-9(8-15)3-5-10)14-11(16)6-7-12(18-14)13(17)20/h2-7H,16H2,1H3,(H2,17,20).
What are the key properties of 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide?
5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(4-cyano-N-methylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 114406485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).