2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide

C23H24N4O2 — CID 109177121

IUPAC2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
SMILESCC(=O)Nc1cccc(Nc2cc(C(=O)Nc3c(C)cc(C)cc3C)ccn2)c1
InChIInChI=1S/C23H24N4O2/c1-14-10-15(2)22(16(3)11-14)27-23(29)18-8-9-24-21(12-18)26-20-7-5-6-19(13-20)25-17(4)28/h5-13H,1-4H3,(H,24,26)(H,25,28)(H,27,29)
InChIKeyJUKOCRBHHAEERZ-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.96
Rot. Bonds5

About 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide

2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide (PubChem CID 109177121) has the molecular formula C23H24N4O2 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
PubChem CID109177121
Molecular FormulaC23H24N4O2
Molecular Weight388.47 g/mol
Exact Mass388.19
IUPAC Name2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
SMILESCC(=O)Nc1cccc(Nc2cc(C(=O)Nc3c(C)cc(C)cc3C)ccn2)c1
InChIInChI=1S/C23H24N4O2/c1-14-10-15(2)22(16(3)11-14)27-23(29)18-8-9-24-21(12-18)26-20-7-5-6-19(13-20)25-17(4)28/h5-13H,1-4H3,(H,24,26)(H,25,28)(H,27,29)
InChIKeyJUKOCRBHHAEERZ-UHFFFAOYSA-N
XLogP4.96
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-acetamidoanilino)-N-(2,6-dimethylphenyl)pyridine-4-carboxamide
CID 109176756
2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide
CID 109176712
2-(3-cyanoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
CID 109177129
N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide
CID 109178526
2-(3-acetamidoanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109178041
2-(3-acetamidoanilino)-N-(3-cyanophenyl)pyridine-4-carboxamide
CID 109178564
2-(4-cyanoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
CID 109177130
2-(3-acetamidoanilino)-N-(2-methoxyphenyl)pyridine-4-carboxamide
CID 109177884
2-(4-acetamidoanilino)-N-(4-methylphenyl)pyridine-4-carboxamide
CID 109176294
N-(3-bromophenyl)-2-(3-methylanilino)pyridine-4-carboxamide
CID 109176276
6-(3-acetamidoanilino)-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
CID 109162750
N-[3-[[6-(3-acetamidoanilino)pyrimidin-4-yl]amino]phenyl]acetamide
CID 112866710

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide (CID 109177121) is 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide is CC(=O)Nc1cccc(Nc2cc(C(=O)Nc3c(C)cc(C)cc3C)ccn2)c1.
What is the InChIKey of 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide?
The InChIKey is JUKOCRBHHAEERZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O2/c1-14-10-15(2)22(16(3)11-14)27-23(29)18-8-9-24-21(12-18)26-20-7-5-6-19(13-20)25-17(4)28/h5-13H,1-4H3,(H,24,26)(H,25,28)(H,27,29).
What are the key properties of 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide?
2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide has a molecular weight of 388.47 g/mol, XLogP of 4.96, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109177121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).