hydron;4-methoxypyridin-2-amine

C6H9N2O+ — CID 131852579

IUPAChydron;4-methoxypyridin-2-amine
SMILESCOc1ccnc(N)c1.[H+]
InChIInChI=1S/C6H8N2O/c1-9-5-2-3-8-6(7)4-5/h2-4H,1H3,(H2,7,8)/p+1
InChIKeyQPHBCOSULYSASF-UHFFFAOYSA-O
MW125.15 g/mol
LogP0.78
Rot. Bonds1

About hydron;4-methoxypyridin-2-amine

hydron;4-methoxypyridin-2-amine (PubChem CID 131852579) has the molecular formula C6H9N2O+ and a molecular weight of 125.15 g/mol. Its IUPAC name is hydron;4-methoxypyridin-2-amine.

Molecular Properties

Compound Namehydron;4-methoxypyridin-2-amine
PubChem CID131852579
Molecular FormulaC6H9N2O+
Molecular Weight125.15 g/mol
Exact Mass125.07
IUPAC Namehydron;4-methoxypyridin-2-amine
SMILESCOc1ccnc(N)c1.[H+]
InChIInChI=1S/C6H8N2O/c1-9-5-2-3-8-6(7)4-5/h2-4H,1H3,(H2,7,8)/p+1
InChIKeyQPHBCOSULYSASF-UHFFFAOYSA-O
XLogP0.78
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.15
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of hydron;4-methoxypyridin-2-amine?
The IUPAC name of hydron;4-methoxypyridin-2-amine (CID 131852579) is hydron;4-methoxypyridin-2-amine.
What is the SMILES notation for hydron;4-methoxypyridin-2-amine?
The canonical SMILES for hydron;4-methoxypyridin-2-amine is COc1ccnc(N)c1.[H+].
What is the InChIKey of hydron;4-methoxypyridin-2-amine?
The InChIKey is QPHBCOSULYSASF-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H8N2O/c1-9-5-2-3-8-6(7)4-5/h2-4H,1H3,(H2,7,8)/p+1.
What are the key properties of hydron;4-methoxypyridin-2-amine?
hydron;4-methoxypyridin-2-amine has a molecular weight of 125.15 g/mol, XLogP of 0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;4-methoxypyridin-2-amine is sourced from PubChem (CID 131852579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).