[2-amino-6-(methoxymethyl)-3-pyridinyl]methanol

C8H12N2O2 — CID 59255403

IUPAC[2-amino-6-(methoxymethyl)-3-pyridinyl]methanol
SMILESCOCc1ccc(CO)c(N)n1
InChIInChI=1S/C8H12N2O2/c1-12-5-7-3-2-6(4-11)8(9)10-7/h2-3,11H,4-5H2,1H3,(H2,9,10)
InChIKeyATKMSQKLOGNUNT-UHFFFAOYSA-N
MW168.20 g/mol
LogP0.30
Rot. Bonds3

About [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol

[2-amino-6-(methoxymethyl)-3-pyridinyl]methanol (PubChem CID 59255403) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-amino-6-(methoxymethyl)-3-pyridinyl]methanol
PubChem CID59255403
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC Name[2-amino-6-(methoxymethyl)-3-pyridinyl]methanol
SMILESCOCc1ccc(CO)c(N)n1
InChIInChI=1S/C8H12N2O2/c1-12-5-7-3-2-6(4-11)8(9)10-7/h2-3,11H,4-5H2,1H3,(H2,9,10)
InChIKeyATKMSQKLOGNUNT-UHFFFAOYSA-N
XLogP0.30
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol?
The IUPAC name of [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol (CID 59255403) is [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol.
What is the SMILES notation for [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol?
The canonical SMILES for [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol is COCc1ccc(CO)c(N)n1.
What is the InChIKey of [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol?
The InChIKey is ATKMSQKLOGNUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2/c1-12-5-7-3-2-6(4-11)8(9)10-7/h2-3,11H,4-5H2,1H3,(H2,9,10).
What are the key properties of [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol?
[2-amino-6-(methoxymethyl)-3-pyridinyl]methanol has a molecular weight of 168.20 g/mol, XLogP of 0.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-6-(methoxymethyl)-3-pyridinyl]methanol is sourced from PubChem (CID 59255403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).