N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide

C22H21N3O4 — CID 108925024

IUPACN-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide
SMILESCCOc1ccccc1OCC(=O)Nc1ccc(NC(=O)c2cccnc2)cc1
InChIInChI=1S/C22H21N3O4/c1-2-28-19-7-3-4-8-20(19)29-15-21(26)24-17-9-11-18(12-10-17)25-22(27)16-6-5-13-23-14-16/h3-14H,2,15H2,1H3,(H,24,26)(H,25,27)
InChIKeyVNUORLQQORAQTO-UHFFFAOYSA-N
MW391.43 g/mol
LogP3.75
Rot. Bonds8

About N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide

N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide (PubChem CID 108925024) has the molecular formula C22H21N3O4 and a molecular weight of 391.43 g/mol. Its IUPAC name is N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide
PubChem CID108925024
Molecular FormulaC22H21N3O4
Molecular Weight391.43 g/mol
Exact Mass391.15
IUPAC NameN-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide
SMILESCCOc1ccccc1OCC(=O)Nc1ccc(NC(=O)c2cccnc2)cc1
InChIInChI=1S/C22H21N3O4/c1-2-28-19-7-3-4-8-20(19)29-15-21(26)24-17-9-11-18(12-10-17)25-22(27)16-6-5-13-23-14-16/h3-14H,2,15H2,1H3,(H,24,26)(H,25,27)
InChIKeyVNUORLQQORAQTO-UHFFFAOYSA-N
XLogP3.75
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.43
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-ethoxyphenoxy)-N-pyridin-4-ylacetamide
CID 78802593
N-[3-[(2-ethoxyphenyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 7311959
N-[2-methoxy-4-[[2-(2-methylphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 38661253
[2-(4-ethoxyanilino)-2-oxoethyl] pyridine-3-carboxylate
CID 649387
N-(4-tert-butylphenyl)-2-(2-ethoxyphenoxy)acetamide
CID 7914312
N-[4-[[(3,4,5-triethoxybenzoyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108925490
N-[[4-[(3,4,5-triethoxybenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108925489
N-[6-(propanoylamino)-3-pyridinyl]pyridine-3-carboxamide
CID 43812722
2-(2-ethoxyphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 24581463
N-(4-acetamidophenyl)pyridine-3-carboxamide
CID 766053
[3-[[3-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]carbamoyl]phenyl] acetate
CID 108927830
N-[3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925180

Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide (CID 108925024) is N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide is CCOc1ccccc1OCC(=O)Nc1ccc(NC(=O)c2cccnc2)cc1.
What is the InChIKey of N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide?
The InChIKey is VNUORLQQORAQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O4/c1-2-28-19-7-3-4-8-20(19)29-15-21(26)24-17-9-11-18(12-10-17)25-22(27)16-6-5-13-23-14-16/h3-14H,2,15H2,1H3,(H,24,26)(H,25,27).
What are the key properties of N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide?
N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide has a molecular weight of 391.43 g/mol, XLogP of 3.75, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(2-ethoxyphenoxy)acetyl]amino]phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 108925024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).