2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide

C14H15N3O2 — CID 106485641

IUPAC2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide
SMILESCc1cc(C(N)=O)cc(Oc2ccc(CN)cc2)n1
InChIInChI=1S/C14H15N3O2/c1-9-6-11(14(16)18)7-13(17-9)19-12-4-2-10(8-15)3-5-12/h2-7H,8,15H2,1H3,(H2,16,18)
InChIKeyOTVMPLNHKQHSSO-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.74
Rot. Bonds4

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

2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide (PubChem CID 106485641) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide
PubChem CID106485641
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide
SMILESCc1cc(C(N)=O)cc(Oc2ccc(CN)cc2)n1
InChIInChI=1S/C14H15N3O2/c1-9-6-11(14(16)18)7-13(17-9)19-12-4-2-10(8-15)3-5-12/h2-7H,8,15H2,1H3,(H2,16,18)
InChIKeyOTVMPLNHKQHSSO-UHFFFAOYSA-N
XLogP1.74
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(2-hydroxyethyl)phenoxy]-6-methylpyridine-4-carboxamide
CID 107709693
4-[[4-(aminomethyl)-6-methyl-2-pyridinyl]oxy]benzamide
CID 114765241
2-[4-(hydroxymethyl)-2-methoxyphenoxy]-6-methylpyridine-4-carboxamide
CID 107743933
N'-hydroxy-2-[4-(2-hydroxyethyl)phenoxy]-6-methylpyridine-4-carboximidamide
CID 136865767
4-[6-methyl-2-(methylamino)pyrimidin-4-yl]oxybenzamide
CID 80882151
[4-(6-ethoxy-2-methylpyrimidin-4-yl)oxyphenyl]methanamine
CID 106485715
2-methyl-6-(3-methylsulfonylphenoxy)pyridine-4-carbothioamide
CID 114768173
2-[4-(aminomethyl)phenoxy]-4-methylbenzamide
CID 106485646
ethyl 6-[4-(aminomethyl)phenoxy]pyridine-3-carboxylate
CID 106485599
3-[4-(aminomethyl)phenoxy]-5-(4-carbamimidoylphenoxy)benzamide
CID 68787822
[4-(aminomethyl)phenyl]methanamine;benzene-1,4-dicarboxamide
CID 68644964
4-(6-methylpyridazin-3-yl)oxybenzamide
CID 175939264

Frequently Asked Questions

What is the IUPAC name of 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide?
The IUPAC name of 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide (CID 106485641) is 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide.
What is the SMILES notation for 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide?
The canonical SMILES for 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide is Cc1cc(C(N)=O)cc(Oc2ccc(CN)cc2)n1.
What is the InChIKey of 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide?
The InChIKey is OTVMPLNHKQHSSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-9-6-11(14(16)18)7-13(17-9)19-12-4-2-10(8-15)3-5-12/h2-7H,8,15H2,1H3,(H2,16,18).
What are the key properties of 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide?
2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 1.74, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(aminomethyl)phenoxy]-6-methylpyridine-4-carboxamide is sourced from PubChem (CID 106485641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).