1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide

C8H11N3O3 — CID 162689055

IUPAC1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide
SMILESCNC(=O)c1c(OC)c(=O)ccn1N
InChIInChI=1S/C8H11N3O3/c1-10-8(13)6-7(14-2)5(12)3-4-11(6)9/h3-4H,9H2,1-2H3,(H,10,13)
InChIKeyXDNICPOLMRBQDC-UHFFFAOYSA-N
MW197.19 g/mol
LogP-1.07
Rot. Bonds2

About 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide

1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide (PubChem CID 162689055) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide.

Molecular Properties

Compound Name1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide
PubChem CID162689055
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC Name1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide
SMILESCNC(=O)c1c(OC)c(=O)ccn1N
InChIInChI=1S/C8H11N3O3/c1-10-8(13)6-7(14-2)5(12)3-4-11(6)9/h3-4H,9H2,1-2H3,(H,10,13)
InChIKeyXDNICPOLMRBQDC-UHFFFAOYSA-N
XLogP-1.07
TPSA86.35 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide?
The IUPAC name of 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide (CID 162689055) is 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide.
What is the SMILES notation for 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide?
The canonical SMILES for 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide is CNC(=O)c1c(OC)c(=O)ccn1N.
What is the InChIKey of 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide?
The InChIKey is XDNICPOLMRBQDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c1-10-8(13)6-7(14-2)5(12)3-4-11(6)9/h3-4H,9H2,1-2H3,(H,10,13).
What are the key properties of 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide?
1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide has a molecular weight of 197.19 g/mol, XLogP of -1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-methoxy-N-methyl-4-oxopyridine-2-carboxamide is sourced from PubChem (CID 162689055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).