isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine

C15H18N2O — CID 103143784

IUPACisoquinolin-8-yl-(1-methoxycyclobutyl)methanamine
SMILESCOC1(C(N)c2cccc3ccncc23)CCC1
InChIInChI=1S/C15H18N2O/c1-18-15(7-3-8-15)14(16)12-5-2-4-11-6-9-17-10-13(11)12/h2,4-6,9-10,14H,3,7-8,16H2,1H3
InChIKeyWVMZDYSTZZTTPX-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.80
Rot. Bonds3

About isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine

isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine (PubChem CID 103143784) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine.

Molecular Properties

Compound Nameisoquinolin-8-yl-(1-methoxycyclobutyl)methanamine
PubChem CID103143784
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Nameisoquinolin-8-yl-(1-methoxycyclobutyl)methanamine
SMILESCOC1(C(N)c2cccc3ccncc23)CCC1
InChIInChI=1S/C15H18N2O/c1-18-15(7-3-8-15)14(16)12-5-2-4-11-6-9-17-10-13(11)12/h2,4-6,9-10,14H,3,7-8,16H2,1H3
InChIKeyWVMZDYSTZZTTPX-UHFFFAOYSA-N
XLogP2.80
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-isoquinolin-8-yl-1-(1-methoxycyclopentyl)-N-methylmethanamine
CID 103143775
3-[amino-(1-methoxycyclobutyl)methyl]pyridin-4-amine
CID 116714089
isoquinolin-8-yl-(2-methylthiolan-2-yl)methanamine
CID 103137667
isoquinolin-8-yl-(1-methoxy-4-methylcyclohexyl)methanol
CID 103143523
3-[amino-(1-methoxycycloheptyl)methyl]pyridin-4-amine
CID 116769953
(1-methoxycycloheptyl)-quinolin-5-ylmethanamine
CID 116769844
isoquinolin-8-yl-(4-methyl-3-pyridinyl)methanamine
CID 103143849
3-cyclopentyl-1-isoquinolin-8-ylpropan-1-amine
CID 103136749
isoquinolin-8-yl-(5-methylfuran-2-yl)methanamine
CID 103137421
(1-ethylcyclopentyl)-isoquinolin-5-ylmethanamine
CID 115853123
isoquinolin-8-yl-(4-methylphenyl)methanamine
CID 103136734
isoquinolin-8-yl(pyridin-3-yl)methanamine
CID 103137345

Frequently Asked Questions

What is the IUPAC name of isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine?
The IUPAC name of isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine (CID 103143784) is isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine.
What is the SMILES notation for isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine?
The canonical SMILES for isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine is COC1(C(N)c2cccc3ccncc23)CCC1.
What is the InChIKey of isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine?
The InChIKey is WVMZDYSTZZTTPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-18-15(7-3-8-15)14(16)12-5-2-4-11-6-9-17-10-13(11)12/h2,4-6,9-10,14H,3,7-8,16H2,1H3.
What are the key properties of isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine?
isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine has a molecular weight of 242.32 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for isoquinolin-8-yl-(1-methoxycyclobutyl)methanamine is sourced from PubChem (CID 103143784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).