(8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine

C12H18N2 — CID 82276255

IUPAC(8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine
SMILESCCc1cccc2c1NCCC2CN
InChIInChI=1S/C12H18N2/c1-2-9-4-3-5-11-10(8-13)6-7-14-12(9)11/h3-5,10,14H,2,6-8,13H2,1H3
InChIKeyYRZKPLJLQUOLOH-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.11
Rot. Bonds2

About (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine

(8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine (PubChem CID 82276255) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine.

Molecular Properties

Compound Name(8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine
PubChem CID82276255
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name(8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine
SMILESCCc1cccc2c1NCCC2CN
InChIInChI=1S/C12H18N2/c1-2-9-4-3-5-11-10(8-13)6-7-14-12(9)11/h3-5,10,14H,2,6-8,13H2,1H3
InChIKeyYRZKPLJLQUOLOH-UHFFFAOYSA-N
XLogP2.11
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine?
The IUPAC name of (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine (CID 82276255) is (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine.
What is the SMILES notation for (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine?
The canonical SMILES for (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine is CCc1cccc2c1NCCC2CN.
What is the InChIKey of (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine?
The InChIKey is YRZKPLJLQUOLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-2-9-4-3-5-11-10(8-13)6-7-14-12(9)11/h3-5,10,14H,2,6-8,13H2,1H3.
What are the key properties of (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine?
(8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine has a molecular weight of 190.29 g/mol, XLogP of 2.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-ethyl-1,2,3,4-tetrahydroquinolin-4-yl)methanamine is sourced from PubChem (CID 82276255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).