7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine

C11H16N2 — CID 165453352

IUPAC7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine
SMILESCCC1CCc2cc(N)ncc2C1
InChIInChI=1S/C11H16N2/c1-2-8-3-4-9-6-11(12)13-7-10(9)5-8/h6-8H,2-5H2,1H3,(H2,12,13)
InChIKeyUOLVUSZWSXEHPV-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.18
Rot. Bonds1

About 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine

7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine (PubChem CID 165453352) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine.

Molecular Properties

Compound Name7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine
PubChem CID165453352
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine
SMILESCCC1CCc2cc(N)ncc2C1
InChIInChI=1S/C11H16N2/c1-2-8-3-4-9-6-11(12)13-7-10(9)5-8/h6-8H,2-5H2,1H3,(H2,12,13)
InChIKeyUOLVUSZWSXEHPV-UHFFFAOYSA-N
XLogP2.18
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Amino-4-methylpyridine
CID 1533
2-Amino-5-methylpyridine
CID 15348
2-(Benzylamino)pyridine
CID 23362
1-Isoquinolinamine
CID 73742
2-Pyridinamine, 4-methyl-N-(phenylmethyl)-
CID 83053
5-Phenyl-2-pyridinamine
CID 105097
Isoquinolin-3-Amine
CID 311869
N-cyclohexyl-4-methylpyridin-2-amine
CID 2366458
Thiourea, N-(5-methyl-2-pyridinyl)-N'-(2-phenylethyl)-
CID 971434
5-[4-(4-Phenyl-3,6-dihydro-2H-pyridin-1-yl)-but-1-ynyl]-pyridin-2-ylamine
CID 10357631
4-Ethylpyridin-2-amine
CID 118425
4,5-Dimethylpyridin-2-amine
CID 12404013

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine?
The IUPAC name of 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine (CID 165453352) is 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine.
What is the SMILES notation for 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine?
The canonical SMILES for 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine is CCC1CCc2cc(N)ncc2C1.
What is the InChIKey of 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine?
The InChIKey is UOLVUSZWSXEHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-2-8-3-4-9-6-11(12)13-7-10(9)5-8/h6-8H,2-5H2,1H3,(H2,12,13).
What are the key properties of 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine?
7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine has a molecular weight of 176.26 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-5,6,7,8-tetrahydroisoquinolin-3-amine is sourced from PubChem (CID 165453352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).