8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine

C12H18N2 — CID 177216962

IUPAC8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine
SMILESCC(C)C1CCCc2c(N)cncc21
InChIInChI=1S/C12H18N2/c1-8(2)9-4-3-5-10-11(9)6-14-7-12(10)13/h6-9H,3-5,13H2,1-2H3
InChIKeyWGXXWISOZZSLEK-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.74
Rot. Bonds1

About 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine

8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine (PubChem CID 177216962) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine.

Molecular Properties

Compound Name8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine
PubChem CID177216962
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine
SMILESCC(C)C1CCCc2c(N)cncc21
InChIInChI=1S/C12H18N2/c1-8(2)9-4-3-5-10-11(9)6-14-7-12(10)13/h6-9H,3-5,13H2,1-2H3
InChIKeyWGXXWISOZZSLEK-UHFFFAOYSA-N
XLogP2.74
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-propan-2-yl-5,6,7,8-tetrahydroquinazoline
CID 58752884
7-ethyl-6,7-dihydro-5H-cyclopenta[c]pyridin-4-amine
CID 176568724
1-chloro-5-propan-2-yl-6,7,8,9-tetrahydro-5H-benzo[7]annulene
CID 171768970
ethane;1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 144539733
4,5-di(propan-2-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridine
CID 170669011
6-methyl-1-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 59559014
3,4-dihydro-2H-pyrano[2,3-c]pyridin-5-amine
CID 170772663
4,5-di(propan-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[c]pyridine
CID 170668940
6-fluoro-3-propan-2-yl-2,3-dihydro-1H-inden-5-amine
CID 166533995
(8R)-8-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 58752937
(4S)-4-propan-2-yl-4,5,6,7-tetrahydro-1H-indene
CID 163830922
ethane;1-methylidene-2-propan-2-ylcyclopentane
CID 142862595

Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine?
The IUPAC name of 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine (CID 177216962) is 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine.
What is the SMILES notation for 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine?
The canonical SMILES for 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine is CC(C)C1CCCc2c(N)cncc21.
What is the InChIKey of 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine?
The InChIKey is WGXXWISOZZSLEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-8(2)9-4-3-5-10-11(9)6-14-7-12(10)13/h6-9H,3-5,13H2,1-2H3.
What are the key properties of 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine?
8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine has a molecular weight of 190.29 g/mol, XLogP of 2.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yl-5,6,7,8-tetrahydroisoquinolin-4-amine is sourced from PubChem (CID 177216962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).