7-methyl-N-piperidin-4-ylisoquinolin-1-amine

C15H19N3 — CID 82570879

IUPAC7-methyl-N-piperidin-4-ylisoquinolin-1-amine
SMILESCc1ccc2ccnc(NC3CCNCC3)c2c1
InChIInChI=1S/C15H19N3/c1-11-2-3-12-4-9-17-15(14(12)10-11)18-13-5-7-16-8-6-13/h2-4,9-10,13,16H,5-8H2,1H3,(H,17,18)
InChIKeyWBFNCIQWOGXFDP-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.71
Rot. Bonds2

About 7-methyl-N-piperidin-4-ylisoquinolin-1-amine

7-methyl-N-piperidin-4-ylisoquinolin-1-amine (PubChem CID 82570879) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 7-methyl-N-piperidin-4-ylisoquinolin-1-amine.

Molecular Properties

Compound Name7-methyl-N-piperidin-4-ylisoquinolin-1-amine
PubChem CID82570879
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name7-methyl-N-piperidin-4-ylisoquinolin-1-amine
SMILESCc1ccc2ccnc(NC3CCNCC3)c2c1
InChIInChI=1S/C15H19N3/c1-11-2-3-12-4-9-17-15(14(12)10-11)18-13-5-7-16-8-6-13/h2-4,9-10,13,16H,5-8H2,1H3,(H,17,18)
InChIKeyWBFNCIQWOGXFDP-UHFFFAOYSA-N
XLogP2.71
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 7-methyl-N-piperidin-4-ylisoquinolin-1-amine 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

7-methyl-N-(oxepan-4-yl)isoquinolin-1-amine
CID 167907426
N,7-dimethylisoquinolin-1-amine
CID 59108894
3,4-diethyl-N-piperidin-4-ylpyridin-2-amine
CID 175211232
N-piperidin-4-ylthieno[3,2-c]pyridin-4-amine
CID 43522721
4-methyl-N-piperidin-4-ylpyrimidin-2-amine
CID 59744254
2-methyl-N-piperidin-4-ylpyrimidin-4-amine;dihydrochloride
CID 67373203
1-(8-azabicyclo[3.2.1]octan-3-ylamino)isoquinolin-7-ol
CID 106540413
1-[(1-oxothian-4-yl)amino]isoquinolin-7-ol
CID 106539617
1,7-dimethylisoquinoline
CID 59050335
1-(piperidin-4-ylamino)isoquinoline-8-carbonitrile
CID 82571269
3-bromo-4-methyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 106876094
7-methoxy-N-(3-methylcyclopentyl)isoquinolin-1-amine
CID 106539967

Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-piperidin-4-ylisoquinolin-1-amine?
The IUPAC name of 7-methyl-N-piperidin-4-ylisoquinolin-1-amine (CID 82570879) is 7-methyl-N-piperidin-4-ylisoquinolin-1-amine.
What is the SMILES notation for 7-methyl-N-piperidin-4-ylisoquinolin-1-amine?
The canonical SMILES for 7-methyl-N-piperidin-4-ylisoquinolin-1-amine is Cc1ccc2ccnc(NC3CCNCC3)c2c1.
What is the InChIKey of 7-methyl-N-piperidin-4-ylisoquinolin-1-amine?
The InChIKey is WBFNCIQWOGXFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-2-3-12-4-9-17-15(14(12)10-11)18-13-5-7-16-8-6-13/h2-4,9-10,13,16H,5-8H2,1H3,(H,17,18).
What are the key properties of 7-methyl-N-piperidin-4-ylisoquinolin-1-amine?
7-methyl-N-piperidin-4-ylisoquinolin-1-amine has a molecular weight of 241.34 g/mol, XLogP of 2.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-piperidin-4-ylisoquinolin-1-amine is sourced from PubChem (CID 82570879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).