3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide

C23H23N3O3 — CID 109105054

IUPAC3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide
SMILESCC(C)Oc1ccccc1NC(=O)c1cncc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C23H23N3O3/c1-16(2)29-21-11-7-6-10-20(21)26-23(28)19-12-18(14-24-15-19)22(27)25-13-17-8-4-3-5-9-17/h3-12,14-16H,13H2,1-2H3,(H,25,27)(H,26,28)
InChIKeySYLRUZYJVIDUSP-UHFFFAOYSA-N
MW389.46 g/mol
LogP4.05
Rot. Bonds7

About 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide

3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide (PubChem CID 109105054) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide
PubChem CID109105054
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide
SMILESCC(C)Oc1ccccc1NC(=O)c1cncc(C(=O)NCc2ccccc2)c1
InChIInChI=1S/C23H23N3O3/c1-16(2)29-21-11-7-6-10-20(21)26-23(28)19-12-18(14-24-15-19)22(27)25-13-17-8-4-3-5-9-17/h3-12,14-16H,13H2,1-2H3,(H,25,27)(H,26,28)
InChIKeySYLRUZYJVIDUSP-UHFFFAOYSA-N
XLogP4.05
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 54.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109231733
3-N-benzyl-5-N-(2-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109105048
3-N-(2-propan-2-yloxyphenyl)-1-N-(pyridin-4-ylmethyl)benzene-1,3-dicarboxamide
CID 109055227
3-N-benzyl-5-N-(2-propan-2-ylphenyl)pyridine-3,5-dicarboxamide
CID 109105028
N-[(3-methylphenyl)methyl]-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109232306
3-N-benzyl-5-N-(4-propan-2-ylphenyl)pyridine-3,5-dicarboxamide
CID 109105029
4-N-(2-propan-2-yloxyphenyl)-2-N-(pyridin-4-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087668
2-N-(2-propan-2-yloxyphenyl)-4-N-(pyridin-3-ylmethyl)pyridine-2,4-dicarboxamide
CID 109087376
5-(2-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245416
N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109245387
N-(2-propan-2-yloxyphenyl)-5-(propylamino)pyridine-3-carboxamide
CID 109223094
5-(piperidine-1-carbonyl)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109102949

Frequently Asked Questions

What is the IUPAC name of 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide?
The IUPAC name of 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide (CID 109105054) is 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide.
What is the SMILES notation for 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide?
The canonical SMILES for 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide is CC(C)Oc1ccccc1NC(=O)c1cncc(C(=O)NCc2ccccc2)c1.
What is the InChIKey of 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide?
The InChIKey is SYLRUZYJVIDUSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-16(2)29-21-11-7-6-10-20(21)26-23(28)19-12-18(14-24-15-19)22(27)25-13-17-8-4-3-5-9-17/h3-12,14-16H,13H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide?
3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide has a molecular weight of 389.46 g/mol, XLogP of 4.05, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-benzyl-5-N-(2-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide is sourced from PubChem (CID 109105054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).