N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide

C16H19N3O — CID 81236414

IUPACN-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1cnc(C)cc1NC
InChIInChI=1S/C16H19N3O/c1-4-12-7-5-6-8-14(12)19-16(20)13-10-18-11(2)9-15(13)17-3/h5-10H,4H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyULUQPUDTJFTXSB-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.25
Rot. Bonds4

About N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide

N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide (PubChem CID 81236414) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
PubChem CID81236414
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1cnc(C)cc1NC
InChIInChI=1S/C16H19N3O/c1-4-12-7-5-6-8-14(12)19-16(20)13-10-18-11(2)9-15(13)17-3/h5-10H,4H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyULUQPUDTJFTXSB-UHFFFAOYSA-N
XLogP3.25
TPSA54.02 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 ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide (CID 81236414) is N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide is CCc1ccccc1NC(=O)c1cnc(C)cc1NC.
What is the InChIKey of N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide?
The InChIKey is ULUQPUDTJFTXSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-4-12-7-5-6-8-14(12)19-16(20)13-10-18-11(2)9-15(13)17-3/h5-10H,4H2,1-3H3,(H,17,18)(H,19,20).
What are the key properties of N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide?
N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81236414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).