2-cyclopentyloxy-1-pyridin-3-ylethanamine

C12H18N2O — CID 141329792

IUPAC2-cyclopentyloxy-1-pyridin-3-ylethanamine
SMILESNC(COC1CCCC1)c1cccnc1
InChIInChI=1S/C12H18N2O/c13-12(10-4-3-7-14-8-10)9-15-11-5-1-2-6-11/h3-4,7-8,11-12H,1-2,5-6,9,13H2
InChIKeyMENSHBULYVLOCK-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.04
Rot. Bonds4

About 2-cyclopentyloxy-1-pyridin-3-ylethanamine

2-cyclopentyloxy-1-pyridin-3-ylethanamine (PubChem CID 141329792) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-cyclopentyloxy-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-cyclopentyloxy-1-pyridin-3-ylethanamine
PubChem CID141329792
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-cyclopentyloxy-1-pyridin-3-ylethanamine
SMILESNC(COC1CCCC1)c1cccnc1
InChIInChI=1S/C12H18N2O/c13-12(10-4-3-7-14-8-10)9-15-11-5-1-2-6-11/h3-4,7-8,11-12H,1-2,5-6,9,13H2
InChIKeyMENSHBULYVLOCK-UHFFFAOYSA-N
XLogP2.04
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 ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyloxy-3-[[(1S)-1-pyridin-3-ylethyl]amino]propan-2-ol
CID 81404417
(1S)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride
CID 171221041
2-cyclopentyloxy-1-(4-methylphenyl)ethanamine
CID 16787694
(1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride
CID 171201503
(S)-cyclohexyl(pyridin-3-yl)methanamine
CID 51888927
2-cyclobutyloxy-2-pyridin-3-ylethanamine
CID 62115429
1-pyridin-3-yl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103214655
1-pyridin-3-ylpropane-1,3-diamine
CID 116932848
2-amino-2-pyridin-3-ylethanol
CID 2734590
(1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride
CID 171201508
amino(pyridin-3-yl)methanethiol
CID 116939546
1-(1,3-benzodioxol-5-yl)-2-cyclopentyloxyethanamine
CID 16796104

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-1-pyridin-3-ylethanamine?
The IUPAC name of 2-cyclopentyloxy-1-pyridin-3-ylethanamine (CID 141329792) is 2-cyclopentyloxy-1-pyridin-3-ylethanamine.
What is the SMILES notation for 2-cyclopentyloxy-1-pyridin-3-ylethanamine?
The canonical SMILES for 2-cyclopentyloxy-1-pyridin-3-ylethanamine is NC(COC1CCCC1)c1cccnc1.
What is the InChIKey of 2-cyclopentyloxy-1-pyridin-3-ylethanamine?
The InChIKey is MENSHBULYVLOCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c13-12(10-4-3-7-14-8-10)9-15-11-5-1-2-6-11/h3-4,7-8,11-12H,1-2,5-6,9,13H2.
What are the key properties of 2-cyclopentyloxy-1-pyridin-3-ylethanamine?
2-cyclopentyloxy-1-pyridin-3-ylethanamine has a molecular weight of 206.29 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-1-pyridin-3-ylethanamine is sourced from PubChem (CID 141329792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).