4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide

C14H15N3O — CID 62156095

IUPAC4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc(N)ccn2)c1C
InChIInChI=1S/C14H15N3O/c1-9-4-3-5-12(10(9)2)17-14(18)13-8-11(15)6-7-16-13/h3-8H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyFFKCEYBBFWNHEB-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.53
Rot. Bonds2

About 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide

4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide (PubChem CID 62156095) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
PubChem CID62156095
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cc(N)ccn2)c1C
InChIInChI=1S/C14H15N3O/c1-9-4-3-5-12(10(9)2)17-14(18)13-8-11(15)6-7-16-13/h3-8H,1-2H3,(H2,15,16)(H,17,18)
InChIKeyFFKCEYBBFWNHEB-UHFFFAOYSA-N
XLogP2.53
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide (CID 62156095) is 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide is Cc1cccc(NC(=O)c2cc(N)ccn2)c1C.
What is the InChIKey of 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The InChIKey is FFKCEYBBFWNHEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-9-4-3-5-12(10(9)2)17-14(18)13-8-11(15)6-7-16-13/h3-8H,1-2H3,(H2,15,16)(H,17,18).
What are the key properties of 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide has a molecular weight of 241.29 g/mol, XLogP of 2.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62156095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).