2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol

C13H19NO2 — CID 106173893

IUPAC2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol
SMILESOC(CNCCC1=CCCC1)c1ccco1
InChIInChI=1S/C13H19NO2/c15-12(13-6-3-9-16-13)10-14-8-7-11-4-1-2-5-11/h3-4,6,9,12,14-15H,1-2,5,7-8,10H2
InChIKeyDMVVLVSFODRASQ-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.40
Rot. Bonds6

About 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol

2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol (PubChem CID 106173893) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol.

Molecular Properties

Compound Name2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol
PubChem CID106173893
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol
SMILESOC(CNCCC1=CCCC1)c1ccco1
InChIInChI=1S/C13H19NO2/c15-12(13-6-3-9-16-13)10-14-8-7-11-4-1-2-5-11/h3-4,6,9,12,14-15H,1-2,5,7-8,10H2
InChIKeyDMVVLVSFODRASQ-UHFFFAOYSA-N
XLogP2.40
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(cyclopenten-1-yl)ethyl]-1-(furan-2-yl)propan-1-amine
CID 106169372
(2S)-1-[2-(cyclopenten-1-yl)ethylamino]propan-2-ol
CID 106174090
2-[2-(cyclopenten-1-yl)ethylamino]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanol
CID 106173895
2-(cyclohexen-1-yl)-N-(furan-2-ylmethyl)ethanamine
CID 17206949
2-[2-(cyclopenten-1-yl)ethylamino]-1-(2,5-dichlorophenyl)ethanol
CID 106174226
(3R)-N-[2-(cyclopenten-1-yl)ethyl]-3-[(2R)-2-(furan-2-yl)-2-hydroxyethyl]morpholine-4-carboxamide
CID 97244674
1-[2-(cyclopenten-1-yl)ethylamino]-3-(diethylamino)propan-2-ol
CID 106173796
1-cyclopropyl-2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]ethanol
CID 63296627
methyl 3-[[2-(furan-2-yl)-2-hydroxyethyl]amino]propanoate
CID 60925426
1-(furan-2-yl)-2-(4-methoxybutylamino)ethanol
CID 60969452
N'-[(2R)-2-(benzenesulfonyl)-2-(furan-2-yl)ethyl]-N-[2-(cyclohexen-1-yl)ethyl]oxamide
CID 27564475
2-[[2-(furan-2-yl)-2-hydroxyethyl]amino]-1-pyrrolidin-1-ylethanone
CID 113406015

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol?
The IUPAC name of 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol (CID 106173893) is 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol.
What is the SMILES notation for 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol?
The canonical SMILES for 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol is OC(CNCCC1=CCCC1)c1ccco1.
What is the InChIKey of 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol?
The InChIKey is DMVVLVSFODRASQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c15-12(13-6-3-9-16-13)10-14-8-7-11-4-1-2-5-11/h3-4,6,9,12,14-15H,1-2,5,7-8,10H2.
What are the key properties of 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol?
2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol has a molecular weight of 221.30 g/mol, XLogP of 2.40, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopenten-1-yl)ethylamino]-1-(furan-2-yl)ethanol is sourced from PubChem (CID 106173893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).