[5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol

C12H14N2O3 — CID 64579186

IUPAC[5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol
SMILESCOc1ncccc1NCc1ccc(CO)o1
InChIInChI=1S/C12H14N2O3/c1-16-12-11(3-2-6-13-12)14-7-9-4-5-10(8-15)17-9/h2-6,14-15H,7-8H2,1H3
InChIKeyXDOBQJFSZBMUOD-UHFFFAOYSA-N
MW234.25 g/mol
LogP1.79
Rot. Bonds5

About [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol

[5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol (PubChem CID 64579186) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol
PubChem CID64579186
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name[5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol
SMILESCOc1ncccc1NCc1ccc(CO)o1
InChIInChI=1S/C12H14N2O3/c1-16-12-11(3-2-6-13-12)14-7-9-4-5-10(8-15)17-9/h2-6,14-15H,7-8H2,1H3
InChIKeyXDOBQJFSZBMUOD-UHFFFAOYSA-N
XLogP1.79
TPSA67.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol with MolForge

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Related Compounds

2-methoxy-N-[(5-nitrofuran-2-yl)methyl]pyridin-3-amine
CID 43786255
[5-[[2-(2-methoxyethyl)anilino]methyl]furan-2-yl]methanol
CID 102847721
2-methoxy-N-[(2-methylpyrazol-3-yl)methyl]pyridin-3-amine
CID 43721974
N-[(5-methylfuran-2-yl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 61375572
[5-[(pyridin-2-ylamino)methyl]furan-2-yl]methanol
CID 115692590
4-[[(2-methoxy-3-pyridinyl)amino]methyl]-2,6-dimethylphenol
CID 43721997
methyl 5-[[(2-methoxy-3-pyridinyl)amino]methyl]-1H-pyrrole-2-carboxylate
CID 79416118
2-hydroxy-N-(2-methoxy-3-pyridinyl)acetamide
CID 126992524
[5-[(4,5-dimethoxy-2-methylanilino)methyl]furan-2-yl]methanol
CID 64580358
N-[(4-bromothiophen-2-yl)methyl]-2-methoxypyridin-3-amine
CID 43721999
methyl 3-[[5-(hydroxymethyl)furan-2-yl]methylamino]-2-methylbenzoate
CID 64580704
2-ethoxy-N-[(5-nitrofuran-2-yl)methyl]pyridin-3-amine
CID 43784052

Frequently Asked Questions

What is the IUPAC name of [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol?
The IUPAC name of [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol (CID 64579186) is [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol is COc1ncccc1NCc1ccc(CO)o1.
What is the InChIKey of [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol?
The InChIKey is XDOBQJFSZBMUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c1-16-12-11(3-2-6-13-12)14-7-9-4-5-10(8-15)17-9/h2-6,14-15H,7-8H2,1H3.
What are the key properties of [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol?
[5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol has a molecular weight of 234.25 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[(2-methoxy-3-pyridinyl)amino]methyl]furan-2-yl]methanol is sourced from PubChem (CID 64579186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).