2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide

C23H23N3O3 — CID 109088996

IUPAC2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCCN(CC)C(=O)c1cc(C(=O)Nc2ccccc2Oc2ccccc2)ccn1
InChIInChI=1S/C23H23N3O3/c1-3-26(4-2)23(28)20-16-17(14-15-24-20)22(27)25-19-12-8-9-13-21(19)29-18-10-6-5-7-11-18/h5-16H,3-4H2,1-2H3,(H,25,27)
InChIKeyXKHFTEBNDCYUBA-UHFFFAOYSA-N
MW389.46 g/mol
LogP4.61
Rot. Bonds7

About 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide

2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109088996) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide
PubChem CID109088996
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCCN(CC)C(=O)c1cc(C(=O)Nc2ccccc2Oc2ccccc2)ccn1
InChIInChI=1S/C23H23N3O3/c1-3-26(4-2)23(28)20-16-17(14-15-24-20)22(27)25-19-12-8-9-13-21(19)29-18-10-6-5-7-11-18/h5-16H,3-4H2,1-2H3,(H,25,27)
InChIKeyXKHFTEBNDCYUBA-UHFFFAOYSA-N
XLogP4.61
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 ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(2-ethoxyphenyl)-2-N,2-N-dipropylpyridine-2,4-dicarboxamide
CID 109090577
2-N-ethyl-4-N-(2-methoxyphenyl)-2-N-phenylpyridine-2,4-dicarboxamide
CID 109092376
2-methylsulfanyl-N-(2-phenoxyphenyl)pyridine-4-carboxamide
CID 60564666
4-N,4-N-diethyl-2-N-(4-phenoxyphenyl)pyridine-2,4-dicarboxamide
CID 109088859
4-N-(4-ethoxyphenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide
CID 109088955
2-N-(2-ethoxyphenyl)-4-N-phenylpyridine-2,4-dicarboxamide
CID 109090848
4-[(2-methoxyphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 115730044
4-N-(3-acetamidophenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide
CID 109088967
4-N-(2,6-difluorophenyl)-2-N,2-N-diethylpyridine-2,4-dicarboxamide
CID 109089015
2-N,2-N-diethyl-4-N-[2-(2-methoxyphenyl)ethyl]pyridine-2,4-dicarboxamide
CID 109088102
4-ethoxy-3-methoxy-N-(2-phenoxyphenyl)benzamide
CID 24583790
N-(2-phenoxyphenyl)-2-pyrrolidin-1-ylpyridine-4-carboxamide
CID 109166024

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide (CID 109088996) is 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide is CCN(CC)C(=O)c1cc(C(=O)Nc2ccccc2Oc2ccccc2)ccn1.
What is the InChIKey of 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is XKHFTEBNDCYUBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-3-26(4-2)23(28)20-16-17(14-15-24-20)22(27)25-19-12-8-9-13-21(19)29-18-10-6-5-7-11-18/h5-16H,3-4H2,1-2H3,(H,25,27).
What are the key properties of 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide?
2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 389.46 g/mol, XLogP of 4.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109088996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).