4-propan-2-yloxypyridin-3-amine

C8H12N2O — CID 21464336

IUPAC4-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ccncc1N
InChIInChI=1S/C8H12N2O/c1-6(2)11-8-3-4-10-5-7(8)9/h3-6H,9H2,1-2H3
InChIKeyOMNWMGVJNXCUIQ-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.45
Rot. Bonds2

About 4-propan-2-yloxypyridin-3-amine

4-propan-2-yloxypyridin-3-amine (PubChem CID 21464336) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 4-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound Name4-propan-2-yloxypyridin-3-amine
PubChem CID21464336
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name4-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ccncc1N
InChIInChI=1S/C8H12N2O/c1-6(2)11-8-3-4-10-5-7(8)9/h3-6H,9H2,1-2H3
InChIKeyOMNWMGVJNXCUIQ-UHFFFAOYSA-N
XLogP1.45
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yloxypyridin-3-amine?
The IUPAC name of 4-propan-2-yloxypyridin-3-amine (CID 21464336) is 4-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for 4-propan-2-yloxypyridin-3-amine?
The canonical SMILES for 4-propan-2-yloxypyridin-3-amine is CC(C)Oc1ccncc1N.
What is the InChIKey of 4-propan-2-yloxypyridin-3-amine?
The InChIKey is OMNWMGVJNXCUIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-6(2)11-8-3-4-10-5-7(8)9/h3-6H,9H2,1-2H3.
What are the key properties of 4-propan-2-yloxypyridin-3-amine?
4-propan-2-yloxypyridin-3-amine has a molecular weight of 152.20 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 21464336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).