5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine

C11H18N2 — CID 170053948

IUPAC5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine
SMILESCc1cc(N)c(CC(C)(C)C)cn1
InChIInChI=1S/C11H18N2/c1-8-5-10(12)9(7-13-8)6-11(2,3)4/h5,7H,6H2,1-4H3,(H2,12,13)
InChIKeyINYRZAIBNRCVAM-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.56
Rot. Bonds1

About 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine

5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine (PubChem CID 170053948) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine.

Molecular Properties

Compound Name5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine
PubChem CID170053948
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine
SMILESCc1cc(N)c(CC(C)(C)C)cn1
InChIInChI=1S/C11H18N2/c1-8-5-10(12)9(7-13-8)6-11(2,3)4/h5,7H,6H2,1-4H3,(H2,12,13)
InChIKeyINYRZAIBNRCVAM-UHFFFAOYSA-N
XLogP2.56
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine?
The IUPAC name of 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine (CID 170053948) is 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine.
What is the SMILES notation for 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine?
The canonical SMILES for 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine is Cc1cc(N)c(CC(C)(C)C)cn1.
What is the InChIKey of 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine?
The InChIKey is INYRZAIBNRCVAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-8-5-10(12)9(7-13-8)6-11(2,3)4/h5,7H,6H2,1-4H3,(H2,12,13).
What are the key properties of 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine?
5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine has a molecular weight of 178.28 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,2-dimethylpropyl)-2-methylpyridin-4-amine is sourced from PubChem (CID 170053948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).