5-methyl-2-(3-methylbutoxy)pyridin-4-amine

C11H18N2O — CID 83266368

IUPAC5-methyl-2-(3-methylbutoxy)pyridin-4-amine
SMILESCc1cnc(OCCC(C)C)cc1N
InChIInChI=1S/C11H18N2O/c1-8(2)4-5-14-11-6-10(12)9(3)7-13-11/h6-8H,4-5H2,1-3H3,(H2,12,13)
InChIKeyVGZKYCVAJKNLPK-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.40
Rot. Bonds4

About 5-methyl-2-(3-methylbutoxy)pyridin-4-amine

5-methyl-2-(3-methylbutoxy)pyridin-4-amine (PubChem CID 83266368) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 5-methyl-2-(3-methylbutoxy)pyridin-4-amine.

Molecular Properties

Compound Name5-methyl-2-(3-methylbutoxy)pyridin-4-amine
PubChem CID83266368
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name5-methyl-2-(3-methylbutoxy)pyridin-4-amine
SMILESCc1cnc(OCCC(C)C)cc1N
InChIInChI=1S/C11H18N2O/c1-8(2)4-5-14-11-6-10(12)9(3)7-13-11/h6-8H,4-5H2,1-3H3,(H2,12,13)
InChIKeyVGZKYCVAJKNLPK-UHFFFAOYSA-N
XLogP2.40
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(3-methylbutoxy)pyridin-4-amine?
The IUPAC name of 5-methyl-2-(3-methylbutoxy)pyridin-4-amine (CID 83266368) is 5-methyl-2-(3-methylbutoxy)pyridin-4-amine.
What is the SMILES notation for 5-methyl-2-(3-methylbutoxy)pyridin-4-amine?
The canonical SMILES for 5-methyl-2-(3-methylbutoxy)pyridin-4-amine is Cc1cnc(OCCC(C)C)cc1N.
What is the InChIKey of 5-methyl-2-(3-methylbutoxy)pyridin-4-amine?
The InChIKey is VGZKYCVAJKNLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-8(2)4-5-14-11-6-10(12)9(3)7-13-11/h6-8H,4-5H2,1-3H3,(H2,12,13).
What are the key properties of 5-methyl-2-(3-methylbutoxy)pyridin-4-amine?
5-methyl-2-(3-methylbutoxy)pyridin-4-amine has a molecular weight of 194.28 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(3-methylbutoxy)pyridin-4-amine is sourced from PubChem (CID 83266368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).