N-(isoquinolin-5-ylmethyl)cyclopentanamine

C15H18N2 — CID 55119141

IUPACN-(isoquinolin-5-ylmethyl)cyclopentanamine
SMILESc1cc(CNC2CCCC2)c2ccncc2c1
InChIInChI=1S/C15H18N2/c1-2-7-14(6-1)17-11-13-5-3-4-12-10-16-9-8-15(12)13/h3-5,8-10,14,17H,1-2,6-7,11H2
InChIKeyNMNGZGJRLANHRW-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.27
Rot. Bonds3

About N-(isoquinolin-5-ylmethyl)cyclopentanamine

N-(isoquinolin-5-ylmethyl)cyclopentanamine (PubChem CID 55119141) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(isoquinolin-5-ylmethyl)cyclopentanamine.

Molecular Properties

Compound NameN-(isoquinolin-5-ylmethyl)cyclopentanamine
PubChem CID55119141
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC NameN-(isoquinolin-5-ylmethyl)cyclopentanamine
SMILESc1cc(CNC2CCCC2)c2ccncc2c1
InChIInChI=1S/C15H18N2/c1-2-7-14(6-1)17-11-13-5-3-4-12-10-16-9-8-15(12)13/h3-5,8-10,14,17H,1-2,6-7,11H2
InChIKeyNMNGZGJRLANHRW-UHFFFAOYSA-N
XLogP3.27
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(isoquinolin-5-ylmethyl)cyclopentanamine 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

N-(isoquinolin-5-ylmethyl)cyclooctanamine
CID 62822995
N-(isoquinolin-5-ylmethyl)cyclopropanamine
CID 58170897
N-(isoquinolin-5-ylmethyl)-2,3-dihydro-1H-inden-2-amine
CID 104694147
N-(naphthalen-1-ylmethyl)cycloheptanamine;hydrochloride
CID 17294536
N-(isoquinolin-5-ylmethyl)-3-methoxycyclopentan-1-amine
CID 103081674
N-(isoquinolin-5-ylmethyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine
CID 62824077
3-[4-(isoquinolin-5-ylmethylamino)piperidin-1-yl]-1-methylpyrazin-2-one
CID 128976621
N-[(5-isoquinolin-5-ylfuran-2-yl)methyl]cyclopropanamine
CID 43808705
(4S)-N-(isoquinolin-5-ylmethyl)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-amine
CID 42516599
N-(isoquinolin-5-ylmethyl)-2-(oxolan-2-yl)ethanamine
CID 62824788
3-(cyclopropylmethoxy)-N-(isoquinolin-5-ylmethyl)propan-1-amine
CID 62823710
1-(2,2-dimethylcyclopropyl)-N-(isoquinolin-5-ylmethyl)methanamine
CID 113381730

Frequently Asked Questions

What is the IUPAC name of N-(isoquinolin-5-ylmethyl)cyclopentanamine?
The IUPAC name of N-(isoquinolin-5-ylmethyl)cyclopentanamine (CID 55119141) is N-(isoquinolin-5-ylmethyl)cyclopentanamine.
What is the SMILES notation for N-(isoquinolin-5-ylmethyl)cyclopentanamine?
The canonical SMILES for N-(isoquinolin-5-ylmethyl)cyclopentanamine is c1cc(CNC2CCCC2)c2ccncc2c1.
What is the InChIKey of N-(isoquinolin-5-ylmethyl)cyclopentanamine?
The InChIKey is NMNGZGJRLANHRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-2-7-14(6-1)17-11-13-5-3-4-12-10-16-9-8-15(12)13/h3-5,8-10,14,17H,1-2,6-7,11H2.
What are the key properties of N-(isoquinolin-5-ylmethyl)cyclopentanamine?
N-(isoquinolin-5-ylmethyl)cyclopentanamine has a molecular weight of 226.32 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(isoquinolin-5-ylmethyl)cyclopentanamine is sourced from PubChem (CID 55119141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).