5-(propan-2-yloxymethyl)pyridin-2-amine

C9H14N2O — CID 62193564

IUPAC5-(propan-2-yloxymethyl)pyridin-2-amine
SMILESCC(C)OCc1ccc(N)nc1
InChIInChI=1S/C9H14N2O/c1-7(2)12-6-8-3-4-9(10)11-5-8/h3-5,7H,6H2,1-2H3,(H2,10,11)
InChIKeyMTRRVZKEXCYKPW-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.59
Rot. Bonds3

About 5-(propan-2-yloxymethyl)pyridin-2-amine

5-(propan-2-yloxymethyl)pyridin-2-amine (PubChem CID 62193564) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 5-(propan-2-yloxymethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(propan-2-yloxymethyl)pyridin-2-amine
PubChem CID62193564
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name5-(propan-2-yloxymethyl)pyridin-2-amine
SMILESCC(C)OCc1ccc(N)nc1
InChIInChI=1S/C9H14N2O/c1-7(2)12-6-8-3-4-9(10)11-5-8/h3-5,7H,6H2,1-2H3,(H2,10,11)
InChIKeyMTRRVZKEXCYKPW-UHFFFAOYSA-N
XLogP1.59
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(propan-2-yloxymethyl)pyridin-2-amine?
The IUPAC name of 5-(propan-2-yloxymethyl)pyridin-2-amine (CID 62193564) is 5-(propan-2-yloxymethyl)pyridin-2-amine.
What is the SMILES notation for 5-(propan-2-yloxymethyl)pyridin-2-amine?
The canonical SMILES for 5-(propan-2-yloxymethyl)pyridin-2-amine is CC(C)OCc1ccc(N)nc1.
What is the InChIKey of 5-(propan-2-yloxymethyl)pyridin-2-amine?
The InChIKey is MTRRVZKEXCYKPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7(2)12-6-8-3-4-9(10)11-5-8/h3-5,7H,6H2,1-2H3,(H2,10,11).
What are the key properties of 5-(propan-2-yloxymethyl)pyridin-2-amine?
5-(propan-2-yloxymethyl)pyridin-2-amine has a molecular weight of 166.22 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(propan-2-yloxymethyl)pyridin-2-amine is sourced from PubChem (CID 62193564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).