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

C17H19N3O3 — CID 109077744

IUPAC2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide
SMILESCCCNC(=O)c1ccnc(C(=O)Nc2cccc(OC)c2)c1
InChIInChI=1S/C17H19N3O3/c1-3-8-19-16(21)12-7-9-18-15(10-12)17(22)20-13-5-4-6-14(11-13)23-2/h4-7,9-11H,3,8H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyUQWKTLAJXWSHEN-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.48
Rot. Bonds6

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

2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide (PubChem CID 109077744) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide
PubChem CID109077744
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC Name2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide
SMILESCCCNC(=O)c1ccnc(C(=O)Nc2cccc(OC)c2)c1
InChIInChI=1S/C17H19N3O3/c1-3-8-19-16(21)12-7-9-18-15(10-12)17(22)20-13-5-4-6-14(11-13)23-2/h4-7,9-11H,3,8H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyUQWKTLAJXWSHEN-UHFFFAOYSA-N
XLogP2.48
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(3-methoxyphenyl)-4-N-(3-phenylpropyl)pyridine-2,4-dicarboxamide
CID 109089049
methyl 3-[[2-(propylcarbamoyl)pyridine-4-carbonyl]amino]benzoate
CID 109077959
4-N-(3-chlorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092816
2-N-(3-cyanophenyl)-4-N-propylpyridine-2,4-dicarboxamide
CID 109077804
4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093066
2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091016
2-N-[2-(3-methoxyphenyl)ethyl]-4-N-phenylpyridine-2,4-dicarboxamide
CID 109088169
4-amino-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 55041968
2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092970
2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093044
2-(3-methoxyanilino)-N-propylpyrimidine-4-carboxamide
CID 109295051
2-N-(3-bromophenyl)-4-N-(3-methoxypropyl)pyridine-2,4-dicarboxamide
CID 109082614

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide (CID 109077744) is 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide is CCCNC(=O)c1ccnc(C(=O)Nc2cccc(OC)c2)c1.
What is the InChIKey of 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide?
The InChIKey is UQWKTLAJXWSHEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-3-8-19-16(21)12-7-9-18-15(10-12)17(22)20-13-5-4-6-14(11-13)23-2/h4-7,9-11H,3,8H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide?
2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide has a molecular weight of 313.36 g/mol, XLogP of 2.48, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-methoxyphenyl)-4-N-propylpyridine-2,4-dicarboxamide is sourced from PubChem (CID 109077744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).