N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide

C22H23N3O2 — CID 109234311

IUPACN-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cncc(NCc2ccccc2OC)c1)c1ccccc1
InChIInChI=1S/C22H23N3O2/c1-3-25(20-10-5-4-6-11-20)22(26)18-13-19(16-23-14-18)24-15-17-9-7-8-12-21(17)27-2/h4-14,16,24H,3,15H2,1-2H3
InChIKeyQTYGVQPJCFXIDQ-UHFFFAOYSA-N
MW361.45 g/mol
LogP4.37
Rot. Bonds7

About N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide

N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide (PubChem CID 109234311) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide
PubChem CID109234311
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC NameN-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide
SMILESCCN(C(=O)c1cncc(NCc2ccccc2OC)c1)c1ccccc1
InChIInChI=1S/C22H23N3O2/c1-3-25(20-10-5-4-6-11-20)22(26)18-13-19(16-23-14-18)24-15-17-9-7-8-12-21(17)27-2/h4-14,16,24H,3,15H2,1-2H3
InChIKeyQTYGVQPJCFXIDQ-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

N-[4-(dimethylamino)phenyl]-5-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109234351
N-[(2-methoxyphenyl)methyl]-5-(propylamino)pyridine-3-carboxamide
CID 109222992
N-ethyl-5-[(4-methoxyphenyl)methylamino]-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109234564
5-(butylamino)-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109224564
5-[(4-fluorophenyl)methylamino]-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109233661
5-(4-acetylanilino)-N-ethyl-N-phenylpyridine-3-carboxamide
CID 109243578
N-(2,5-dimethoxyphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109234341
N-(3-chloro-4-methoxyphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109234331
N-ethyl-5-(3-methylanilino)-N-phenylpyridine-3-carboxamide
CID 109241929
6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide
CID 109097988
5-(2,6-diethylanilino)-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109234214
N-ethyl-5-(N-ethylanilino)-N-phenylpyridine-3-carboxamide
CID 109243544

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide?
The IUPAC name of N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide (CID 109234311) is N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide.
What is the SMILES notation for N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide?
The canonical SMILES for N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide is CCN(C(=O)c1cncc(NCc2ccccc2OC)c1)c1ccccc1.
What is the InChIKey of N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide?
The InChIKey is QTYGVQPJCFXIDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-3-25(20-10-5-4-6-11-20)22(26)18-13-19(16-23-14-18)24-15-17-9-7-8-12-21(17)27-2/h4-14,16,24H,3,15H2,1-2H3.
What are the key properties of N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide?
N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-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 N-ethyl-5-[(2-methoxyphenyl)methylamino]-N-phenylpyridine-3-carboxamide is sourced from PubChem (CID 109234311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).