[6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine

C12H18N2O — CID 106907587

IUPAC[6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine
SMILESNCc1cccc(COC2CCCC2)n1
InChIInChI=1S/C12H18N2O/c13-8-10-4-3-5-11(14-10)9-15-12-6-1-2-7-12/h3-5,12H,1-2,6-9,13H2
InChIKeyLEBYNOSVAABTES-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.00
Rot. Bonds4

About [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine

[6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine (PubChem CID 106907587) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine
PubChem CID106907587
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name[6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine
SMILESNCc1cccc(COC2CCCC2)n1
InChIInChI=1S/C12H18N2O/c13-8-10-4-3-5-11(14-10)9-15-12-6-1-2-7-12/h3-5,12H,1-2,6-9,13H2
InChIKeyLEBYNOSVAABTES-UHFFFAOYSA-N
XLogP2.00
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine?
The IUPAC name of [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine (CID 106907587) is [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine.
What is the SMILES notation for [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine?
The canonical SMILES for [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine is NCc1cccc(COC2CCCC2)n1.
What is the InChIKey of [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine?
The InChIKey is LEBYNOSVAABTES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c13-8-10-4-3-5-11(14-10)9-15-12-6-1-2-7-12/h3-5,12H,1-2,6-9,13H2.
What are the key properties of [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine?
[6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine has a molecular weight of 206.29 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(cyclopentyloxymethyl)-2-pyridinyl]methanamine is sourced from PubChem (CID 106907587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).