3-propan-2-yloxypyridin-2-amine;hydrochloride

C8H13ClN2O — CID 75493334

IUPAC3-propan-2-yloxypyridin-2-amine;hydrochloride
SMILESCC(C)Oc1cccnc1N.Cl
InChIInChI=1S/C8H12N2O.ClH/c1-6(2)11-7-4-3-5-10-8(7)9;/h3-6H,1-2H3,(H2,9,10);1H
InChIKeyILBUMEUPTPHQHE-UHFFFAOYSA-N
MW188.66 g/mol
LogP1.87
Rot. Bonds2

About 3-propan-2-yloxypyridin-2-amine;hydrochloride

3-propan-2-yloxypyridin-2-amine;hydrochloride (PubChem CID 75493334) has the molecular formula C8H13ClN2O and a molecular weight of 188.66 g/mol. Its IUPAC name is 3-propan-2-yloxypyridin-2-amine;hydrochloride.

Molecular Properties

Compound Name3-propan-2-yloxypyridin-2-amine;hydrochloride
PubChem CID75493334
Molecular FormulaC8H13ClN2O
Molecular Weight188.66 g/mol
Exact Mass188.07
IUPAC Name3-propan-2-yloxypyridin-2-amine;hydrochloride
SMILESCC(C)Oc1cccnc1N.Cl
InChIInChI=1S/C8H12N2O.ClH/c1-6(2)11-7-4-3-5-10-8(7)9;/h3-6H,1-2H3,(H2,9,10);1H
InChIKeyILBUMEUPTPHQHE-UHFFFAOYSA-N
XLogP1.87
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.66
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-propan-2-yloxypyridin-2-amine;hydrochloride?
The IUPAC name of 3-propan-2-yloxypyridin-2-amine;hydrochloride (CID 75493334) is 3-propan-2-yloxypyridin-2-amine;hydrochloride.
What is the SMILES notation for 3-propan-2-yloxypyridin-2-amine;hydrochloride?
The canonical SMILES for 3-propan-2-yloxypyridin-2-amine;hydrochloride is CC(C)Oc1cccnc1N.Cl.
What is the InChIKey of 3-propan-2-yloxypyridin-2-amine;hydrochloride?
The InChIKey is ILBUMEUPTPHQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O.ClH/c1-6(2)11-7-4-3-5-10-8(7)9;/h3-6H,1-2H3,(H2,9,10);1H.
What are the key properties of 3-propan-2-yloxypyridin-2-amine;hydrochloride?
3-propan-2-yloxypyridin-2-amine;hydrochloride has a molecular weight of 188.66 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-propan-2-yloxypyridin-2-amine;hydrochloride is sourced from PubChem (CID 75493334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).