1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine

C15H18N2 — CID 43298300

IUPAC1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
SMILESc1cnc2c(CNCC3CCC3)cccc2c1
InChIInChI=1S/C15H18N2/c1-4-12(5-1)10-16-11-14-7-2-6-13-8-3-9-17-15(13)14/h2-3,6-9,12,16H,1,4-5,10-11H2
InChIKeyWZZXGIKMWGKLTH-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.12
Rot. Bonds4

About 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine

1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine (PubChem CID 43298300) has the molecular formula C15H18N2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
PubChem CID43298300
Molecular FormulaC15H18N2
Molecular Weight226.32 g/mol
Exact Mass226.15
IUPAC Name1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
SMILESc1cnc2c(CNCC3CCC3)cccc2c1
InChIInChI=1S/C15H18N2/c1-4-12(5-1)10-16-11-14-7-2-6-13-8-3-9-17-15(13)14/h2-3,6-9,12,16H,1,4-5,10-11H2
InChIKeyWZZXGIKMWGKLTH-UHFFFAOYSA-N
XLogP3.12
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine?
The IUPAC name of 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine (CID 43298300) is 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine.
What is the SMILES notation for 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine?
The canonical SMILES for 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine is c1cnc2c(CNCC3CCC3)cccc2c1.
What is the InChIKey of 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine?
The InChIKey is WZZXGIKMWGKLTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2/c1-4-12(5-1)10-16-11-14-7-2-6-13-8-3-9-17-15(13)14/h2-3,6-9,12,16H,1,4-5,10-11H2.
What are the key properties of 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine?
1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine has a molecular weight of 226.32 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine is sourced from PubChem (CID 43298300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).