4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide

C16H19N3O — CID 81235051

IUPAC4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1cnccc1N
InChIInChI=1S/C16H19N3O/c1-3-11-6-5-7-12(4-2)15(11)19-16(20)13-10-18-9-8-14(13)17/h5-10H,3-4H2,1-2H3,(H2,17,18)(H,19,20)
InChIKeyVNPGZRJTWNDMMV-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.04
Rot. Bonds4

About 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide

4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide (PubChem CID 81235051) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide
PubChem CID81235051
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1cnccc1N
InChIInChI=1S/C16H19N3O/c1-3-11-6-5-7-12(4-2)15(11)19-16(20)13-10-18-9-8-14(13)17/h5-10H,3-4H2,1-2H3,(H2,17,18)(H,19,20)
InChIKeyVNPGZRJTWNDMMV-UHFFFAOYSA-N
XLogP3.04
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide?
The IUPAC name of 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide (CID 81235051) is 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide is CCc1cccc(CC)c1NC(=O)c1cnccc1N.
What is the InChIKey of 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide?
The InChIKey is VNPGZRJTWNDMMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-11-6-5-7-12(4-2)15(11)19-16(20)13-10-18-9-8-14(13)17/h5-10H,3-4H2,1-2H3,(H2,17,18)(H,19,20).
What are the key properties of 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide?
4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 81235051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).