6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide

C14H15N3O3 — CID 107743265

IUPAC6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(Oc2ccc(CO)cc2OC)nc1
InChIInChI=1S/C14H15N3O3/c1-19-12-6-9(8-18)2-4-11(12)20-13-5-3-10(7-17-13)14(15)16/h2-7,18H,8H2,1H3,(H3,15,16)
InChIKeyJQOUIWHCRLOLAC-UHFFFAOYSA-N
MW273.29 g/mol
LogP1.66
Rot. Bonds5

About 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide

6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide (PubChem CID 107743265) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide.

Molecular Properties

Compound Name6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide
PubChem CID107743265
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide
SMILES[H]/N=C(\N)c1ccc(Oc2ccc(CO)cc2OC)nc1
InChIInChI=1S/C14H15N3O3/c1-19-12-6-9(8-18)2-4-11(12)20-13-5-3-10(7-17-13)14(15)16/h2-7,18H,8H2,1H3,(H3,15,16)
InChIKeyJQOUIWHCRLOLAC-UHFFFAOYSA-N
XLogP1.66
TPSA101.45 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

3-fluoro-4-[4-(hydroxymethyl)-2-methoxyphenoxy]benzenecarboximidamide
CID 107743283
5-fluoro-2-[4-(hydroxymethyl)-2-methoxyphenoxy]benzenecarboximidamide
CID 107743256
(3-methoxy-4-pyridin-2-yloxyphenyl)methanol
CID 103610323
6-(2,4,5-trichlorophenoxy)pyridine-3-carboximidamide
CID 29293672
6-(4-methoxy-2-nitrophenoxy)pyridine-3-carboximidamide
CID 61031687
6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carboximidamide
CID 43352096
2-[4-(hydroxymethyl)-2-methoxyphenoxy]-3-methylbenzenecarboximidamide
CID 107743296
4-(3-fluoropropoxy)-3-methoxybenzenecarboximidamide
CID 81106848
3-methoxy-4-propoxybenzenecarboximidamide
CID 24709016
[4-(5,6-dimethylpyrazin-2-yl)oxy-3-methoxyphenyl]methanol
CID 107744072
6-(2-chloro-4-fluorophenoxy)pyridine-3-carboximidamide
CID 54880716
6-(2-fluoro-5-methylphenoxy)pyridine-3-carboximidamide
CID 64855796

Frequently Asked Questions

What is the IUPAC name of 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide?
The IUPAC name of 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide (CID 107743265) is 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide.
What is the SMILES notation for 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide?
The canonical SMILES for 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide is [H]/N=C(\N)c1ccc(Oc2ccc(CO)cc2OC)nc1.
What is the InChIKey of 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide?
The InChIKey is JQOUIWHCRLOLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-19-12-6-9(8-18)2-4-11(12)20-13-5-3-10(7-17-13)14(15)16/h2-7,18H,8H2,1H3,(H3,15,16).
What are the key properties of 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide?
6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide has a molecular weight of 273.29 g/mol, XLogP of 1.66, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(hydroxymethyl)-2-methoxyphenoxy]pyridine-3-carboximidamide is sourced from PubChem (CID 107743265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).