2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine

C18H26N2 — CID 82448311

IUPAC2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine
SMILESCCc1ccc2nc(C(C)(C)C)cc(C(C)(C)N)c2c1
InChIInChI=1S/C18H26N2/c1-7-12-8-9-15-13(10-12)14(18(5,6)19)11-16(20-15)17(2,3)4/h8-11H,7,19H2,1-6H3
InChIKeyMWLNFJKIIUNXNH-UHFFFAOYSA-N
MW270.42 g/mol
LogP4.29
Rot. Bonds2

About 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine

2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine (PubChem CID 82448311) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine.

Molecular Properties

Compound Name2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine
PubChem CID82448311
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine
SMILESCCc1ccc2nc(C(C)(C)C)cc(C(C)(C)N)c2c1
InChIInChI=1S/C18H26N2/c1-7-12-8-9-15-13(10-12)14(18(5,6)19)11-16(20-15)17(2,3)4/h8-11H,7,19H2,1-6H3
InChIKeyMWLNFJKIIUNXNH-UHFFFAOYSA-N
XLogP4.29
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine?
The IUPAC name of 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine (CID 82448311) is 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine.
What is the SMILES notation for 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine?
The canonical SMILES for 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine is CCc1ccc2nc(C(C)(C)C)cc(C(C)(C)N)c2c1.
What is the InChIKey of 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine?
The InChIKey is MWLNFJKIIUNXNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-7-12-8-9-15-13(10-12)14(18(5,6)19)11-16(20-15)17(2,3)4/h8-11H,7,19H2,1-6H3.
What are the key properties of 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine?
2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine has a molecular weight of 270.42 g/mol, XLogP of 4.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-6-ethylquinolin-4-yl)propan-2-amine is sourced from PubChem (CID 82448311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).