2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide

C14H14N2O3 — CID 79868967

IUPAC2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(N)=O)c(Oc2ccc(CO)cc2)n1
InChIInChI=1S/C14H14N2O3/c1-9-2-7-12(13(15)18)14(16-9)19-11-5-3-10(8-17)4-6-11/h2-7,17H,8H2,1H3,(H2,15,18)
InChIKeyPFOVRKVYKYNYDT-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.77
Rot. Bonds4

About 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide

2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide (PubChem CID 79868967) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide
PubChem CID79868967
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide
SMILESCc1ccc(C(N)=O)c(Oc2ccc(CO)cc2)n1
InChIInChI=1S/C14H14N2O3/c1-9-2-7-12(13(15)18)14(16-9)19-11-5-3-10(8-17)4-6-11/h2-7,17H,8H2,1H3,(H2,15,18)
InChIKeyPFOVRKVYKYNYDT-UHFFFAOYSA-N
XLogP1.77
TPSA85.44 Ų
H-Bond Donors2
H-Bond Acceptors4
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 ≤ 104

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Related Compounds

N'-hydroxy-2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboximidamide
CID 76916322
6-methyl-2-[4-(methylaminomethyl)phenoxy]pyridine-3-carboxamide
CID 106486726
N'-hydroxy-2-(4-methoxyphenoxy)-6-methylpyridine-3-carboximidamide
CID 56675946
N'-hydroxy-2-[4-(hydroxymethyl)phenoxy]-4,6-dimethylpyridine-3-carboximidamide
CID 61228172
4-(hydroxymethyl)-2-methylbenzamide
CID 69484226
2-[4-(hydroxymethyl)phenoxy]-4,6-dimethylpyridine-3-carboximidamide
CID 61229142
6-methylsulfanyl-2-phenoxypyridine-3-carboxamide
CID 142991898
3-[4-(hydroxymethyl)phenoxy]-5,6-dimethylpyridazine-4-carbothioamide
CID 61229528
2-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91385199
2,6-dimethylpyridine-3-carboxamide
CID 2824850
2-[4-(2-hydroxyethyl)phenoxy]pyridine-3-carboxamide
CID 107709590
6-chloro-2-(4-phenoxyphenoxy)pyridine-3-carboxamide
CID 118038351

Frequently Asked Questions

What is the IUPAC name of 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide?
The IUPAC name of 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide (CID 79868967) is 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide?
The canonical SMILES for 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide is Cc1ccc(C(N)=O)c(Oc2ccc(CO)cc2)n1.
What is the InChIKey of 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide?
The InChIKey is PFOVRKVYKYNYDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c1-9-2-7-12(13(15)18)14(16-9)19-11-5-3-10(8-17)4-6-11/h2-7,17H,8H2,1H3,(H2,15,18).
What are the key properties of 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide?
2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(hydroxymethyl)phenoxy]-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 79868967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).