N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide

C14H14N2O3 — CID 107261705

IUPACN-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide
SMILESCOCc1cccc(NC(=O)c2cccc(=O)[nH]2)c1
InChIInChI=1S/C14H14N2O3/c1-19-9-10-4-2-5-11(8-10)15-14(18)12-6-3-7-13(17)16-12/h2-8H,9H2,1H3,(H,15,18)(H,16,17)
InChIKeyXRVBSMSTSSCGBX-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.77
Rot. Bonds4

About N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide

N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 107261705) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide
PubChem CID107261705
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC NameN-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide
SMILESCOCc1cccc(NC(=O)c2cccc(=O)[nH]2)c1
InChIInChI=1S/C14H14N2O3/c1-19-9-10-4-2-5-11(8-10)15-14(18)12-6-3-7-13(17)16-12/h2-8H,9H2,1H3,(H,15,18)(H,16,17)
InChIKeyXRVBSMSTSSCGBX-UHFFFAOYSA-N
XLogP1.77
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-N-[3-(methoxymethyl)phenyl]-1H-indole-2-carboxamide
CID 32639423
4-benzamido-N-[3-(methoxymethyl)phenyl]benzamide
CID 32639408
4-hydrazinyl-N-[3-(methoxymethyl)phenyl]benzamide
CID 62247351
N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 107261392
N-[3-(methoxymethyl)phenyl]thiophene-2-carboxamide
CID 32638339
2-[[3-(methoxymethyl)phenyl]carbamoyl]benzoyl chloride
CID 142115034
2-iodo-N-[3-(methoxymethyl)phenyl]benzamide
CID 1313720
N-(4-amino-3-methylphenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 114040045
N-[3-(methoxymethyl)phenyl]-2-methylfuran-3-carboxamide
CID 32638658
2-fluoro-N-[3-(methoxymethyl)phenyl]-3-methylbenzamide
CID 80718071
2-fluoro-6-hydroxy-N-[3-(methoxymethyl)phenyl]benzamide
CID 104916789
N-naphthalen-2-yl-6-oxo-1H-pyridine-2-carboxamide
CID 107261405

Frequently Asked Questions

What is the IUPAC name of N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide (CID 107261705) is N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide is COCc1cccc(NC(=O)c2cccc(=O)[nH]2)c1.
What is the InChIKey of N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is XRVBSMSTSSCGBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-19-9-10-4-2-5-11(8-10)15-14(18)12-6-3-7-13(17)16-12/h2-8H,9H2,1H3,(H,15,18)(H,16,17).
What are the key properties of N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide?
N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methoxymethyl)phenyl]-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 107261705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).