2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine

C12H20N2 — CID 130507574

IUPAC2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine
SMILESCc1cc(NC(C)C(C)C)cc(C)n1
InChIInChI=1S/C12H20N2/c1-8(2)11(5)14-12-6-9(3)13-10(4)7-12/h6-8,11H,1-5H3,(H,13,14)
InChIKeyBBHPVMKOZRQSER-UHFFFAOYSA-N
MW192.31 g/mol
LogP3.15
Rot. Bonds3

About 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine

2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine (PubChem CID 130507574) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine
PubChem CID130507574
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine
SMILESCc1cc(NC(C)C(C)C)cc(C)n1
InChIInChI=1S/C12H20N2/c1-8(2)11(5)14-12-6-9(3)13-10(4)7-12/h6-8,11H,1-5H3,(H,13,14)
InChIKeyBBHPVMKOZRQSER-UHFFFAOYSA-N
XLogP3.15
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine?
The IUPAC name of 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine (CID 130507574) is 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine.
What is the SMILES notation for 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine?
The canonical SMILES for 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine is Cc1cc(NC(C)C(C)C)cc(C)n1.
What is the InChIKey of 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine?
The InChIKey is BBHPVMKOZRQSER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-8(2)11(5)14-12-6-9(3)13-10(4)7-12/h6-8,11H,1-5H3,(H,13,14).
What are the key properties of 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine?
2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine has a molecular weight of 192.31 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(3-methylbutan-2-yl)pyridin-4-amine is sourced from PubChem (CID 130507574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).