2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide

C24H25N3O3 — CID 86896413

IUPAC2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide
SMILESCc1cccc(Oc2ccccc2CNC(=O)c2ccc(C(=O)N(C)C)nc2C)c1
InChIInChI=1S/C24H25N3O3/c1-16-8-7-10-19(14-16)30-22-11-6-5-9-18(22)15-25-23(28)20-12-13-21(26-17(20)2)24(29)27(3)4/h5-14H,15H2,1-4H3,(H,25,28)
InChIKeyLBPSTZGCNQXRPY-UHFFFAOYSA-N
MW403.48 g/mol
LogP4.12
Rot. Bonds6

About 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide

2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide (PubChem CID 86896413) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide
PubChem CID86896413
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC Name2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide
SMILESCc1cccc(Oc2ccccc2CNC(=O)c2ccc(C(=O)N(C)C)nc2C)c1
InChIInChI=1S/C24H25N3O3/c1-16-8-7-10-19(14-16)30-22-11-6-5-9-18(22)15-25-23(28)20-12-13-21(26-17(20)2)24(29)27(3)4/h5-14H,15H2,1-4H3,(H,25,28)
InChIKeyLBPSTZGCNQXRPY-UHFFFAOYSA-N
XLogP4.12
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide with MolForge

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Related Compounds

2-chloro-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide
CID 146085901
N-[[2-(3-methylphenoxy)phenyl]methyl]but-2-ynamide
CID 146083553
5-N-[[2-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]-2-N,2-N,6-trimethylpyridine-2,5-dicarboxamide
CID 86891548
1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-methyl-3-[[2-(3-methylphenoxy)phenyl]methyl]guanidine;hydroiodide
CID 109428300
2-(2-methoxyethylamino)-N-[[2-(3-methylphenoxy)phenyl]methyl]acetamide
CID 119777851
5-N-[(3-bromo-4-methoxyphenyl)methyl]-2-N,2-N,6-trimethylpyridine-2,5-dicarboxamide
CID 86890470
5-N-[4-(2-cyanophenoxy)phenyl]-2-N,2-N,6-trimethylpyridine-2,5-dicarboxamide
CID 86890386
1-[[2-(3-methylphenoxy)phenyl]methylcarbamoyl]piperidine-4-carboxylic acid
CID 122001141
N-[[2-(3-methylphenoxy)phenyl]methyl]propan-2-amine
CID 43283112
5-N-[[3-[(3,5-dimethylpyrazol-1-yl)methyl]phenyl]methyl]-2-N,2-N,6-trimethylpyridine-2,5-dicarboxamide
CID 86891594
N-[2-[[2-(3-methylphenoxy)phenyl]methylamino]-2-oxoethyl]cyclopentanecarboxamide
CID 86897083
2-N,2-N,6-trimethyl-5-N-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methyl]pyridine-2,5-dicarboxamide
CID 86890232

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide?
The IUPAC name of 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide (CID 86896413) is 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide.
What is the SMILES notation for 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide?
The canonical SMILES for 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide is Cc1cccc(Oc2ccccc2CNC(=O)c2ccc(C(=O)N(C)C)nc2C)c1.
What is the InChIKey of 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide?
The InChIKey is LBPSTZGCNQXRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-16-8-7-10-19(14-16)30-22-11-6-5-9-18(22)15-25-23(28)20-12-13-21(26-17(20)2)24(29)27(3)4/h5-14H,15H2,1-4H3,(H,25,28).
What are the key properties of 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide?
2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide has a molecular weight of 403.48 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,6-trimethyl-5-N-[[2-(3-methylphenoxy)phenyl]methyl]pyridine-2,5-dicarboxamide is sourced from PubChem (CID 86896413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).