2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine

C15H20N2 — CID 82242686

IUPAC2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine
SMILESCc1cc2cccc(C(C)C)c2nc1CCN
InChIInChI=1S/C15H20N2/c1-10(2)13-6-4-5-12-9-11(3)14(7-8-16)17-15(12)13/h4-6,9-10H,7-8,16H2,1-3H3
InChIKeyHABAZXQJOAPFCB-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.17
Rot. Bonds3

About 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine

2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine (PubChem CID 82242686) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine
PubChem CID82242686
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine
SMILESCc1cc2cccc(C(C)C)c2nc1CCN
InChIInChI=1S/C15H20N2/c1-10(2)13-6-4-5-12-9-11(3)14(7-8-16)17-15(12)13/h4-6,9-10H,7-8,16H2,1-3H3
InChIKeyHABAZXQJOAPFCB-UHFFFAOYSA-N
XLogP3.17
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine?
The IUPAC name of 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine (CID 82242686) is 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine.
What is the SMILES notation for 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine?
The canonical SMILES for 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine is Cc1cc2cccc(C(C)C)c2nc1CCN.
What is the InChIKey of 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine?
The InChIKey is HABAZXQJOAPFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-10(2)13-6-4-5-12-9-11(3)14(7-8-16)17-15(12)13/h4-6,9-10H,7-8,16H2,1-3H3.
What are the key properties of 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine?
2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine has a molecular weight of 228.34 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-8-propan-2-ylquinolin-2-yl)ethanamine is sourced from PubChem (CID 82242686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).