1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine

C16H20N2O — CID 64573735

IUPAC1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine
SMILESNC1(COCc2ccc3ncccc3c2)CCCC1
InChIInChI=1S/C16H20N2O/c17-16(7-1-2-8-16)12-19-11-13-5-6-15-14(10-13)4-3-9-18-15/h3-6,9-10H,1-2,7-8,11-12,17H2
InChIKeyLJEXCNHJGAOYLP-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.02
Rot. Bonds4

About 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine

1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine (PubChem CID 64573735) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine
PubChem CID64573735
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine
SMILESNC1(COCc2ccc3ncccc3c2)CCCC1
InChIInChI=1S/C16H20N2O/c17-16(7-1-2-8-16)12-19-11-13-5-6-15-14(10-13)4-3-9-18-15/h3-6,9-10H,1-2,7-8,11-12,17H2
InChIKeyLJEXCNHJGAOYLP-UHFFFAOYSA-N
XLogP3.02
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(quinolin-6-ylmethoxymethyl)cyclopentan-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

Frequently Asked Questions

What is the IUPAC name of 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine?
The IUPAC name of 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine (CID 64573735) is 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine?
The canonical SMILES for 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine is NC1(COCc2ccc3ncccc3c2)CCCC1.
What is the InChIKey of 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine?
The InChIKey is LJEXCNHJGAOYLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c17-16(7-1-2-8-16)12-19-11-13-5-6-15-14(10-13)4-3-9-18-15/h3-6,9-10H,1-2,7-8,11-12,17H2.
What are the key properties of 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine?
1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine has a molecular weight of 256.35 g/mol, XLogP of 3.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine is sourced from PubChem (CID 64573735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).