4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide

C16H15Cl2N3O2 — CID 109077995

IUPAC4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide
SMILESCCCNC(=O)c1cc(C(=O)Nc2cccc(Cl)c2Cl)ccn1
InChIInChI=1S/C16H15Cl2N3O2/c1-2-7-20-16(23)13-9-10(6-8-19-13)15(22)21-12-5-3-4-11(17)14(12)18/h3-6,8-9H,2,7H2,1H3,(H,20,23)(H,21,22)
InChIKeyXBUQVUUGENHWBB-UHFFFAOYSA-N
MW352.22 g/mol
LogP3.78
Rot. Bonds5

About 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide

4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide (PubChem CID 109077995) has the molecular formula C16H15Cl2N3O2 and a molecular weight of 352.22 g/mol. Its IUPAC name is 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide
PubChem CID109077995
Molecular FormulaC16H15Cl2N3O2
Molecular Weight352.22 g/mol
Exact Mass351.05
IUPAC Name4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide
SMILESCCCNC(=O)c1cc(C(=O)Nc2cccc(Cl)c2Cl)ccn1
InChIInChI=1S/C16H15Cl2N3O2/c1-2-7-20-16(23)13-9-10(6-8-19-13)15(22)21-12-5-3-4-11(17)14(12)18/h3-6,8-9H,2,7H2,1H3,(H,20,23)(H,21,22)
InChIKeyXBUQVUUGENHWBB-UHFFFAOYSA-N
XLogP3.78
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.22
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-(2,3-dichlorophenyl)-4-N-(3-methoxypropyl)pyridine-2,4-dicarboxamide
CID 109082627
2-N-(2-bromophenyl)-4-N-propylpyridine-2,4-dicarboxamide
CID 109077777
methyl 3-[[2-(propylcarbamoyl)pyridine-4-carbonyl]amino]benzoate
CID 109077959
2-N,4-N-bis(2-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092181
4-N-(4-bromophenyl)-2-N-propylpyridine-2,4-dicarboxamide
CID 109077938
4-N-(4-ethylphenyl)-2-N-propylpyridine-2,4-dicarboxamide
CID 109077915
2-N-(2-chlorophenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109090478
2-N-(2-chlorophenyl)-4-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092591
2-N-(3-chloro-2-methylphenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109090481
2-N-butyl-4-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109079471
2-N-butyl-4-N-(2-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109079552
2-N-butyl-4-N-[2-(trifluoromethyl)phenyl]pyridine-2,4-dicarboxamide
CID 109079504

Frequently Asked Questions

What is the IUPAC name of 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide (CID 109077995) is 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide is CCCNC(=O)c1cc(C(=O)Nc2cccc(Cl)c2Cl)ccn1.
What is the InChIKey of 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide?
The InChIKey is XBUQVUUGENHWBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2N3O2/c1-2-7-20-16(23)13-9-10(6-8-19-13)15(22)21-12-5-3-4-11(17)14(12)18/h3-6,8-9H,2,7H2,1H3,(H,20,23)(H,21,22).
What are the key properties of 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide?
4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide has a molecular weight of 352.22 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2,3-dichlorophenyl)-2-N-propylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109077995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).