5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide

C22H23N3O2 — CID 109234877

IUPAC5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCCN(Cc1ccccc1)c1cncc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C22H23N3O2/c1-3-25(16-17-9-5-4-6-10-17)19-13-18(14-23-15-19)22(26)24-20-11-7-8-12-21(20)27-2/h4-15H,3,16H2,1-2H3,(H,24,26)
InChIKeyATFIXEVZAQXQST-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.37
Rot. Bonds7

About 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide

5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 109234877) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide
PubChem CID109234877
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide
SMILESCCN(Cc1ccccc1)c1cncc(C(=O)Nc2ccccc2OC)c1
InChIInChI=1S/C22H23N3O2/c1-3-25(16-17-9-5-4-6-10-17)19-13-18(14-23-15-19)22(26)24-20-11-7-8-12-21(20)27-2/h4-15H,3,16H2,1-2H3,(H,24,26)
InChIKeyATFIXEVZAQXQST-UHFFFAOYSA-N
XLogP4.37
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[benzyl(ethyl)amino]-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 109234876
5-[benzyl(ethyl)amino]-N-phenylpyridine-3-carboxamide
CID 109234844
methyl 3-[[5-[benzyl(ethyl)amino]pyridine-3-carbonyl]amino]benzoate
CID 109234896
3-N-benzyl-5-N-(2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109105048
5-[benzyl(methyl)amino]-N-(2,4-dimethoxyphenyl)pyridine-3-carboxamide
CID 109233239
5-N-(2-methoxyphenyl)-3-N-phenylpyridine-3,5-dicarboxamide
CID 109107789
3-N-(2-methoxyphenyl)-5-N-methyl-5-N-phenylpyridine-3,5-dicarboxamide
CID 109108084
2-[benzyl(ethyl)amino]-N-(2,4-dimethoxyphenyl)pyrimidine-5-carboxamide
CID 109258498
5-[benzyl(ethyl)amino]-N-(3-chloro-4-methylphenyl)pyridine-3-carboxamide
CID 109234873
N-(2-bromophenyl)-5-(diethylamino)pyridine-3-carboxamide
CID 109238971
2-[benzyl(ethyl)amino]-N-(5-chloro-2-methoxyphenyl)pyrimidine-5-carboxamide
CID 109258488
N-(2,5-dimethoxyphenyl)-5-(N-ethylanilino)pyridine-3-carboxamide
CID 109243638

Frequently Asked Questions

What is the IUPAC name of 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide (CID 109234877) is 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide is CCN(Cc1ccccc1)c1cncc(C(=O)Nc2ccccc2OC)c1.
What is the InChIKey of 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is ATFIXEVZAQXQST-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-3-25(16-17-9-5-4-6-10-17)19-13-18(14-23-15-19)22(26)24-20-11-7-8-12-21(20)27-2/h4-15H,3,16H2,1-2H3,(H,24,26).
What are the key properties of 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide?
5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[benzyl(ethyl)amino]-N-(2-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109234877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).