4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide

C23H23N3O3 — CID 109088154

IUPAC4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
SMILESCOc1cccc(CCNC(=O)c2ccnc(C(=O)N(C)c3ccccc3)c2)c1
InChIInChI=1S/C23H23N3O3/c1-26(19-8-4-3-5-9-19)23(28)21-16-18(12-14-24-21)22(27)25-13-11-17-7-6-10-20(15-17)29-2/h3-10,12,14-16H,11,13H2,1-2H3,(H,25,27)
InChIKeyQSEUNIDXPSLVPV-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.34
Rot. Bonds7

About 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide

4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide (PubChem CID 109088154) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
PubChem CID109088154
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
SMILESCOc1cccc(CCNC(=O)c2ccnc(C(=O)N(C)c3ccccc3)c2)c1
InChIInChI=1S/C23H23N3O3/c1-26(19-8-4-3-5-9-19)23(28)21-16-18(12-14-24-21)22(27)25-13-11-17-7-6-10-20(15-17)29-2/h3-10,12,14-16H,11,13H2,1-2H3,(H,25,27)
InChIKeyQSEUNIDXPSLVPV-UHFFFAOYSA-N
XLogP3.34
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-[2-(3-methoxyphenyl)ethyl]-6-N-methyl-6-N-phenylpyridine-2,6-dicarboxamide
CID 109098650
2-(N-ethylanilino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109172872
2-N-[2-(3-methoxyphenyl)ethyl]-4-N-phenylpyridine-2,4-dicarboxamide
CID 109088169
2-N-methyl-2-N-phenyl-4-N-propylpyridine-2,4-dicarboxamide
CID 109077708
2-(benzylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109169514
N-[2-(3-methoxyphenyl)ethyl]-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109081831
4-N-(4-methoxyphenyl)-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
CID 109091500
N-[2-(3-methoxyphenyl)ethyl]-6-(N-methylanilino)pyrimidine-4-carboxamide
CID 109351369
2-(cyclopropylamino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 109165237
N-[2-(3-methoxyphenyl)ethyl]-2-(1-phenylethylamino)pyridine-4-carboxamide
CID 109170133
4-N-[(2-methoxyphenyl)methyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
CID 109086804
2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide
CID 84580463

Frequently Asked Questions

What is the IUPAC name of 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide (CID 109088154) is 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide is COc1cccc(CCNC(=O)c2ccnc(C(=O)N(C)c3ccccc3)c2)c1.
What is the InChIKey of 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide?
The InChIKey is QSEUNIDXPSLVPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-26(19-8-4-3-5-9-19)23(28)21-16-18(12-14-24-21)22(27)25-13-11-17-7-6-10-20(15-17)29-2/h3-10,12,14-16H,11,13H2,1-2H3,(H,25,27).
What are the key properties of 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide?
4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide has a molecular weight of 389.46 g/mol, XLogP of 3.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109088154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).