6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide

C18H19N3O3 — CID 109093839

IUPAC6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide
SMILESCOc1ccc(CNC(=O)c2cccc(C(=O)NC3CC3)n2)cc1
InChIInChI=1S/C18H19N3O3/c1-24-14-9-5-12(6-10-14)11-19-17(22)15-3-2-4-16(21-15)18(23)20-13-7-8-13/h2-6,9-10,13H,7-8,11H2,1H3,(H,19,22)(H,20,23)
InChIKeyLSZWGFFRGBVCLC-UHFFFAOYSA-N
MW325.37 g/mol
LogP1.91
Rot. Bonds6

About 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide

6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide (PubChem CID 109093839) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide
PubChem CID109093839
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide
SMILESCOc1ccc(CNC(=O)c2cccc(C(=O)NC3CC3)n2)cc1
InChIInChI=1S/C18H19N3O3/c1-24-14-9-5-12(6-10-14)11-19-17(22)15-3-2-4-16(21-15)18(23)20-13-7-8-13/h2-6,9-10,13H,7-8,11H2,1H3,(H,19,22)(H,20,23)
InChIKeyLSZWGFFRGBVCLC-UHFFFAOYSA-N
XLogP1.91
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-[(4-chlorophenyl)methyl]-6-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093837
2-N-[(4-methoxyphenyl)methyl]-6-N-(pyridin-4-ylmethyl)pyridine-2,6-dicarboxamide
CID 109098007
6-N-[(4-methoxyphenyl)methyl]-2-N-(3-methylbutyl)pyridine-2,6-dicarboxamide
CID 109098012
6-N-cyclohexyl-2-N-[(4-fluorophenyl)methyl]pyridine-2,6-dicarboxamide
CID 109095286
2-N-cyclohexyl-4-N-[(4-methoxyphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109081527
6-N-(4-methoxyphenyl)-2-N-[(4-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097550
6-N-(3-methoxyphenyl)-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109098040
N-cyclopropyl-5-[(4-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109179866
6-N-cycloheptyl-2-N-[(3-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097432
6-N-(4-methoxyphenyl)-2-N-(pyridin-4-ylmethyl)pyridine-2,6-dicarboxamide
CID 109098383
2-(cyclopropylamino)-N-[(4-methoxyphenyl)methyl]-6-methylpyrimidine-4-carboxamide
CID 109319676
6-N-cyclopropyl-2-N-(pyridin-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109093842

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide (CID 109093839) is 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide is COc1ccc(CNC(=O)c2cccc(C(=O)NC3CC3)n2)cc1.
What is the InChIKey of 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide?
The InChIKey is LSZWGFFRGBVCLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c1-24-14-9-5-12(6-10-14)11-19-17(22)15-3-2-4-16(21-15)18(23)20-13-7-8-13/h2-6,9-10,13H,7-8,11H2,1H3,(H,19,22)(H,20,23).
What are the key properties of 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide?
6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide has a molecular weight of 325.37 g/mol, XLogP of 1.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-cyclopropyl-2-N-[(4-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109093839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).