5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide

C19H21N3O4 — CID 126648941

IUPAC5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2ccc(OC)cc2)c1=O
InChIInChI=1S/C19H21N3O4/c1-20-18(24)16-9-13(17(23)21-14-5-6-14)11-22(19(16)25)10-12-3-7-15(26-2)8-4-12/h3-4,7-9,11,14H,5-6,10H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyVBSQIPSWUGCQMA-UHFFFAOYSA-N
MW355.39 g/mol
LogP1.16
Rot. Bonds6

About 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide

5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide (PubChem CID 126648941) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide.

Molecular Properties

Compound Name5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
PubChem CID126648941
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC Name5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
SMILESCNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2ccc(OC)cc2)c1=O
InChIInChI=1S/C19H21N3O4/c1-20-18(24)16-9-13(17(23)21-14-5-6-14)11-22(19(16)25)10-12-3-7-15(26-2)8-4-12/h3-4,7-9,11,14H,5-6,10H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyVBSQIPSWUGCQMA-UHFFFAOYSA-N
XLogP1.16
TPSA89.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The IUPAC name of 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide (CID 126648941) is 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide.
What is the SMILES notation for 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The canonical SMILES for 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide is CNC(=O)c1cc(C(=O)NC2CC2)cn(Cc2ccc(OC)cc2)c1=O.
What is the InChIKey of 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
The InChIKey is VBSQIPSWUGCQMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c1-20-18(24)16-9-13(17(23)21-14-5-6-14)11-22(19(16)25)10-12-3-7-15(26-2)8-4-12/h3-4,7-9,11,14H,5-6,10H2,1-2H3,(H,20,24)(H,21,23).
What are the key properties of 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide?
5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide has a molecular weight of 355.39 g/mol, XLogP of 1.16, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-cyclopropyl-1-[(4-methoxyphenyl)methyl]-3-N-methyl-2-oxopyridine-3,5-dicarboxamide is sourced from PubChem (CID 126648941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).