4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide

C15H17N3O — CID 62153378

IUPAC4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1cc(N)ccn1
InChIInChI=1S/C15H17N3O/c1-3-11-6-4-5-10(2)14(11)18-15(19)13-9-12(16)7-8-17-13/h4-9H,3H2,1-2H3,(H2,16,17)(H,18,19)
InChIKeyLJTOXZUVFIEUIY-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.79
Rot. Bonds3

About 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide

4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide (PubChem CID 62153378) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide
PubChem CID62153378
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1cc(N)ccn1
InChIInChI=1S/C15H17N3O/c1-3-11-6-4-5-10(2)14(11)18-15(19)13-9-12(16)7-8-17-13/h4-9H,3H2,1-2H3,(H2,16,17)(H,18,19)
InChIKeyLJTOXZUVFIEUIY-UHFFFAOYSA-N
XLogP2.79
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.79
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-ethyl-6-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide (CID 62153378) is 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide is CCc1cccc(C)c1NC(=O)c1cc(N)ccn1.
What is the InChIKey of 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide?
The InChIKey is LJTOXZUVFIEUIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-3-11-6-4-5-10(2)14(11)18-15(19)13-9-12(16)7-8-17-13/h4-9H,3H2,1-2H3,(H2,16,17)(H,18,19).
What are the key properties of 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide?
4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.79, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-ethyl-6-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62153378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).