5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine

C12H20N2O — CID 137457657

IUPAC5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine
SMILESCc1cnc(OC(C)C)c(NC(C)C)c1
InChIInChI=1S/C12H20N2O/c1-8(2)14-11-6-10(5)7-13-12(11)15-9(3)4/h6-9,14H,1-5H3
InChIKeyHMSPPGSXAJSXQZ-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.00
Rot. Bonds4

About 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine

5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine (PubChem CID 137457657) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound Name5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine
PubChem CID137457657
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine
SMILESCc1cnc(OC(C)C)c(NC(C)C)c1
InChIInChI=1S/C12H20N2O/c1-8(2)14-11-6-10(5)7-13-12(11)15-9(3)4/h6-9,14H,1-5H3
InChIKeyHMSPPGSXAJSXQZ-UHFFFAOYSA-N
XLogP3.00
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine (CID 137457657) is 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine is Cc1cnc(OC(C)C)c(NC(C)C)c1.
What is the InChIKey of 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine?
The InChIKey is HMSPPGSXAJSXQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-8(2)14-11-6-10(5)7-13-12(11)15-9(3)4/h6-9,14H,1-5H3.
What are the key properties of 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine?
5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine has a molecular weight of 208.30 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-propan-2-yl-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 137457657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).