4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide

C12H13N3O2 — CID 63882428

IUPAC4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cc(COCc2ccco2)ccn1
InChIInChI=1S/C12H13N3O2/c13-12(14)11-6-9(3-4-15-11)7-16-8-10-2-1-5-17-10/h1-6H,7-8H2,(H3,13,14)
InChIKeyWVFSJHTYVFETDI-UHFFFAOYSA-N
MW231.26 g/mol
LogP1.68
Rot. Bonds5

About 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide

4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide (PubChem CID 63882428) has the molecular formula C12H13N3O2 and a molecular weight of 231.26 g/mol. Its IUPAC name is 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide.

Molecular Properties

Compound Name4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide
PubChem CID63882428
Molecular FormulaC12H13N3O2
Molecular Weight231.26 g/mol
Exact Mass231.10
IUPAC Name4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cc(COCc2ccco2)ccn1
InChIInChI=1S/C12H13N3O2/c13-12(14)11-6-9(3-4-15-11)7-16-8-10-2-1-5-17-10/h1-6H,7-8H2,(H3,13,14)
InChIKeyWVFSJHTYVFETDI-UHFFFAOYSA-N
XLogP1.68
TPSA85.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

4-(thiophen-2-ylmethoxymethyl)pyridine-2-carboximidamide
CID 63880687
4-[(4-methoxyphenyl)methoxymethyl]pyridine-2-carboximidamide
CID 63882445
2-(furan-2-ylmethoxy)pyridine-4-carboximidamide
CID 24705015
4-(hydroxymethyl)pyridine-2-carboximidamide
CID 63882803
4-[2-(3-methoxypropoxy)ethoxymethyl]pyridine-2-carboximidamide
CID 103177983
4-[[2-(hydroxymethyl)phenoxy]methyl]pyridine-2-carboximidamide
CID 63880691
3-chloro-4-(furan-2-ylmethoxymethyl)benzenecarboximidamide
CID 102668088
4-[(3-tert-butylphenoxy)methyl]pyridine-2-carboximidamide
CID 63882454
4-[2-(4-methyl-1,3-thiazol-5-yl)ethoxymethyl]pyridine-2-carboximidamide
CID 63882610
4-[(4-propylphenoxy)methyl]pyridine-2-carboximidamide
CID 63882645
4-[(3-propan-2-ylphenoxy)methyl]pyridine-2-carboximidamide
CID 63882440
4-[(dimethylamino)methyl]pyridine-2-carboximidamide
CID 63880470

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide?
The IUPAC name of 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide (CID 63882428) is 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide.
What is the SMILES notation for 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide?
The canonical SMILES for 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide is [H]/N=C(\N)c1cc(COCc2ccco2)ccn1.
What is the InChIKey of 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide?
The InChIKey is WVFSJHTYVFETDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c13-12(14)11-6-9(3-4-15-11)7-16-8-10-2-1-5-17-10/h1-6H,7-8H2,(H3,13,14).
What are the key properties of 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide?
4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide has a molecular weight of 231.26 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-ylmethoxymethyl)pyridine-2-carboximidamide is sourced from PubChem (CID 63882428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).