N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide

C22H23N3O2 — CID 109176999

IUPACN-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccnc(Nc2cccc(OC)c2)c1
InChIInChI=1S/C22H23N3O2/c1-4-16-8-5-7-15(2)21(16)25-22(26)17-11-12-23-20(13-17)24-18-9-6-10-19(14-18)27-3/h5-14H,4H2,1-3H3,(H,23,24)(H,25,26)
InChIKeyAVLBGMICNPAXLJ-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.96
Rot. Bonds6

About N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide

N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide (PubChem CID 109176999) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
PubChem CID109176999
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
SMILESCCc1cccc(C)c1NC(=O)c1ccnc(Nc2cccc(OC)c2)c1
InChIInChI=1S/C22H23N3O2/c1-4-16-8-5-7-15(2)21(16)25-22(26)17-11-12-23-20(13-17)24-18-9-6-10-19(14-18)27-3/h5-14H,4H2,1-3H3,(H,23,24)(H,25,26)
InChIKeyAVLBGMICNPAXLJ-UHFFFAOYSA-N
XLogP4.96
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethyl-6-methylphenyl)-6-(3-methoxyanilino)pyridine-3-carboxamide
CID 109162989
N-(2-ethyl-6-methylphenyl)-4-(3-methoxyanilino)pyridine-2-carboxamide
CID 109220361
2-(4-acetylanilino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 109177005
N-(2,6-difluorophenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
CID 109178031
ethyl 4-[[2-(3-methoxyanilino)pyridine-4-carbonyl]amino]benzoate
CID 109178018
2-(ethylamino)-N-(2-ethyl-6-methylphenyl)pyridine-4-carboxamide
CID 62184923
methyl 2-(3-methoxyanilino)pyridine-4-carboxylate
CID 68663874
2-(4-ethoxyanilino)-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109177953
2-(3-bromoanilino)-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109177974
N-(3-bromophenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide
CID 109178014
2-(3-chloroanilino)-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 109177464
2-(3-acetamidoanilino)-N-(2,6-dimethylphenyl)pyridine-4-carboxamide
CID 109176756

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide (CID 109176999) is N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide is CCc1cccc(C)c1NC(=O)c1ccnc(Nc2cccc(OC)c2)c1.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide?
The InChIKey is AVLBGMICNPAXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-4-16-8-5-7-15(2)21(16)25-22(26)17-11-12-23-20(13-17)24-18-9-6-10-19(14-18)27-3/h5-14H,4H2,1-3H3,(H,23,24)(H,25,26).
What are the key properties of N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide?
N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 4.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-2-(3-methoxyanilino)pyridine-4-carboxamide is sourced from PubChem (CID 109176999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).