(1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine

C15H20N2O2 — CID 97322477

IUPAC(1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine
SMILESCCc1ccc([C@H](C)NCCOc2cccnc2)o1
InChIInChI=1S/C15H20N2O2/c1-3-13-6-7-15(19-13)12(2)17-9-10-18-14-5-4-8-16-11-14/h4-8,11-12,17H,3,9-10H2,1-2H3/t12-/m0/s1
InChIKeyRSRWHNBXFYSZLK-LBPRGKRZSA-N
MW260.34 g/mol
LogP2.97
Rot. Bonds7

About (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine

(1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine (PubChem CID 97322477) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine.

Molecular Properties

Compound Name(1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine
PubChem CID97322477
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name(1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine
SMILESCCc1ccc([C@H](C)NCCOc2cccnc2)o1
InChIInChI=1S/C15H20N2O2/c1-3-13-6-7-15(19-13)12(2)17-9-10-18-14-5-4-8-16-11-14/h4-8,11-12,17H,3,9-10H2,1-2H3/t12-/m0/s1
InChIKeyRSRWHNBXFYSZLK-LBPRGKRZSA-N
XLogP2.97
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N-(2-pyridin-3-yloxyethyl)pentan-3-amine
CID 115720180
2-[2-[1-(5-ethylfuran-2-yl)ethylamino]ethoxy]ethanol
CID 115707279
N-(2-pyridin-3-yloxyethyl)hexan-3-amine
CID 115905779
(1S)-1-(5-methylthiophen-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine
CID 97232073
(1S)-N-(2-phenoxyethyl)-1-pyridin-3-ylethanamine
CID 81404248
3-(3-chloropropoxy)pyridine;N-propan-2-yl-3-pyridin-3-yloxypropan-1-amine
CID 18433344
N-ethyl-4-pyridin-3-yloxybutan-1-amine
CID 62451744
3-propan-2-yloxy-N-(2-pyridin-3-yloxyethyl)propan-1-amine
CID 62583458
[(5-ethylfuran-2-yl)-pyridin-3-ylmethyl]hydrazine
CID 105287099
1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine
CID 105034717
2-butoxy-N-(2-pyridin-3-yloxyethyl)ethanamine
CID 55092985
2-(dimethylamino)-N-(3-pyridin-3-yloxypropyl)propanamide
CID 119060315

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine?
The IUPAC name of (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine (CID 97322477) is (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine.
What is the SMILES notation for (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine?
The canonical SMILES for (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine is CCc1ccc([C@H](C)NCCOc2cccnc2)o1.
What is the InChIKey of (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine?
The InChIKey is RSRWHNBXFYSZLK-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-3-13-6-7-15(19-13)12(2)17-9-10-18-14-5-4-8-16-11-14/h4-8,11-12,17H,3,9-10H2,1-2H3/t12-/m0/s1.
What are the key properties of (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine?
(1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine has a molecular weight of 260.34 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(5-ethylfuran-2-yl)-N-(2-pyridin-3-yloxyethyl)ethanamine is sourced from PubChem (CID 97322477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).