N-methoxy-N-methylpyridine-3-carboxamide

C8H10N2O2 — CID 10558996

IUPACN-methoxy-N-methylpyridine-3-carboxamide
SMILESCON(C)C(=O)c1cccnc1
InChIInChI=1S/C8H10N2O2/c1-10(12-2)8(11)7-4-3-5-9-6-7/h3-6H,1-2H3
InChIKeyKFEZCMOHRDCFIQ-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.71
Rot. Bonds2

About N-methoxy-N-methylpyridine-3-carboxamide

N-methoxy-N-methylpyridine-3-carboxamide (PubChem CID 10558996) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is N-methoxy-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-methoxy-N-methylpyridine-3-carboxamide
PubChem CID10558996
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC NameN-methoxy-N-methylpyridine-3-carboxamide
SMILESCON(C)C(=O)c1cccnc1
InChIInChI=1S/C8H10N2O2/c1-10(12-2)8(11)7-4-3-5-9-6-7/h3-6H,1-2H3
InChIKeyKFEZCMOHRDCFIQ-UHFFFAOYSA-N
XLogP0.71
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-methylpyridine-3-carboxamide?
The IUPAC name of N-methoxy-N-methylpyridine-3-carboxamide (CID 10558996) is N-methoxy-N-methylpyridine-3-carboxamide.
What is the SMILES notation for N-methoxy-N-methylpyridine-3-carboxamide?
The canonical SMILES for N-methoxy-N-methylpyridine-3-carboxamide is CON(C)C(=O)c1cccnc1.
What is the InChIKey of N-methoxy-N-methylpyridine-3-carboxamide?
The InChIKey is KFEZCMOHRDCFIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-10(12-2)8(11)7-4-3-5-9-6-7/h3-6H,1-2H3.
What are the key properties of N-methoxy-N-methylpyridine-3-carboxamide?
N-methoxy-N-methylpyridine-3-carboxamide has a molecular weight of 166.18 g/mol, XLogP of 0.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 10558996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).