2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine

C13H20N2O — CID 79169733

IUPAC2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine
SMILESCc1ccc(OC2CCCC2)c(CCN)n1
InChIInChI=1S/C13H20N2O/c1-10-6-7-13(12(15-10)8-9-14)16-11-4-2-3-5-11/h6-7,11H,2-5,8-9,14H2,1H3
InChIKeyHNSDMNPXMCZBCW-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.21
Rot. Bonds4

About 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine

2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine (PubChem CID 79169733) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine
PubChem CID79169733
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine
SMILESCc1ccc(OC2CCCC2)c(CCN)n1
InChIInChI=1S/C13H20N2O/c1-10-6-7-13(12(15-10)8-9-14)16-11-4-2-3-5-11/h6-7,11H,2-5,8-9,14H2,1H3
InChIKeyHNSDMNPXMCZBCW-UHFFFAOYSA-N
XLogP2.21
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine?
The IUPAC name of 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine (CID 79169733) is 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine is Cc1ccc(OC2CCCC2)c(CCN)n1.
What is the InChIKey of 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine?
The InChIKey is HNSDMNPXMCZBCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-6-7-13(12(15-10)8-9-14)16-11-4-2-3-5-11/h6-7,11H,2-5,8-9,14H2,1H3.
What are the key properties of 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine?
2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine has a molecular weight of 220.32 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopentyloxy-6-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 79169733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).