3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide

C22H21N3O3 — CID 109105396

IUPAC3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide
SMILESCOc1cccc(NC(=O)c2cncc(C(=O)NC(C)c3ccccc3)c2)c1
InChIInChI=1S/C22H21N3O3/c1-15(16-7-4-3-5-8-16)24-21(26)17-11-18(14-23-13-17)22(27)25-19-9-6-10-20(12-19)28-2/h3-15H,1-2H3,(H,24,26)(H,25,27)
InChIKeyHCZVUZCELBUFIJ-UHFFFAOYSA-N
MW375.43 g/mol
LogP3.83
Rot. Bonds6

About 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide

3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide (PubChem CID 109105396) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide
PubChem CID109105396
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC Name3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide
SMILESCOc1cccc(NC(=O)c2cncc(C(=O)NC(C)c3ccccc3)c2)c1
InChIInChI=1S/C22H21N3O3/c1-15(16-7-4-3-5-8-16)24-21(26)17-11-18(14-23-13-17)22(27)25-19-9-6-10-20(12-19)28-2/h3-15H,1-2H3,(H,24,26)(H,25,27)
InChIKeyHCZVUZCELBUFIJ-UHFFFAOYSA-N
XLogP3.83
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-methoxyphenyl)-N-[(1S)-1-phenylethyl]pyridine-3-carboxamide
CID 58833104
5-N-(2-methoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108873
5-(4-methoxyanilino)-N-(1-phenylethyl)pyridine-3-carboxamide
CID 109232834
3-N-(4-ethylphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide
CID 109105379
5-N-(2-fluorophenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108683
N-(3-methoxyphenyl)-N'-(1-phenylethyl)propanediamide
CID 108945966
5-(benzylamino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109231885
N-[(1S)-1-(3-methoxyphenyl)ethyl]-5-(4-methylphenyl)pyridine-3-carboxamide
CID 95053218
methyl 3-[[5-(1-phenylethylcarbamoyl)-3-pyridinyl]amino]benzoate
CID 109232851
5-N-(2-ethoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108895
5-(3-methoxyphenyl)-N-[(1S)-1-(4-methylphenyl)ethyl]pyridine-3-carboxamide
CID 95053221
1-(3-methoxyphenyl)-3-[(1R)-1-phenylethyl]thiourea
CID 8619758

Frequently Asked Questions

What is the IUPAC name of 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide (CID 109105396) is 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide is COc1cccc(NC(=O)c2cncc(C(=O)NC(C)c3ccccc3)c2)c1.
What is the InChIKey of 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide?
The InChIKey is HCZVUZCELBUFIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c1-15(16-7-4-3-5-8-16)24-21(26)17-11-18(14-23-13-17)22(27)25-19-9-6-10-20(12-19)28-2/h3-15H,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide?
3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide has a molecular weight of 375.43 g/mol, XLogP of 3.83, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(3-methoxyphenyl)-5-N-(1-phenylethyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).