6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide

C15H17N3O — CID 62239482

IUPAC6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
SMILESCCN(C(=O)c1cccc(N)n1)c1cccc(C)c1
InChIInChI=1S/C15H17N3O/c1-3-18(12-7-4-6-11(2)10-12)15(19)13-8-5-9-14(16)17-13/h4-10H,3H2,1-2H3,(H2,16,17)
InChIKeyLAYXXMNAGXUHGF-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.64
Rot. Bonds3

About 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide

6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide (PubChem CID 62239482) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
PubChem CID62239482
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide
SMILESCCN(C(=O)c1cccc(N)n1)c1cccc(C)c1
InChIInChI=1S/C15H17N3O/c1-3-18(12-7-4-6-11(2)10-12)15(19)13-8-5-9-14(16)17-13/h4-10H,3H2,1-2H3,(H2,16,17)
InChIKeyLAYXXMNAGXUHGF-UHFFFAOYSA-N
XLogP2.64
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide (CID 62239482) is 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide is CCN(C(=O)c1cccc(N)n1)c1cccc(C)c1.
What is the InChIKey of 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide?
The InChIKey is LAYXXMNAGXUHGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-3-18(12-7-4-6-11(2)10-12)15(19)13-8-5-9-14(16)17-13/h4-10H,3H2,1-2H3,(H2,16,17).
What are the key properties of 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide?
6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-ethyl-N-(3-methylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62239482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).