2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol

C11H16ClNO2 — CID 115674021

IUPAC2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol
SMILESOCCC1(NCc2ccc(Cl)o2)CCC1
InChIInChI=1S/C11H16ClNO2/c12-10-3-2-9(15-10)8-13-11(6-7-14)4-1-5-11/h2-3,13-14H,1,4-8H2
InChIKeyWYHGKRIHNIPOJP-UHFFFAOYSA-N
MW229.71 g/mol
LogP2.33
Rot. Bonds5

About 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol

2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol (PubChem CID 115674021) has the molecular formula C11H16ClNO2 and a molecular weight of 229.71 g/mol. Its IUPAC name is 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol.

Molecular Properties

Compound Name2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol
PubChem CID115674021
Molecular FormulaC11H16ClNO2
Molecular Weight229.71 g/mol
Exact Mass229.09
IUPAC Name2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol
SMILESOCCC1(NCc2ccc(Cl)o2)CCC1
InChIInChI=1S/C11H16ClNO2/c12-10-3-2-9(15-10)8-13-11(6-7-14)4-1-5-11/h2-3,13-14H,1,4-8H2
InChIKeyWYHGKRIHNIPOJP-UHFFFAOYSA-N
XLogP2.33
TPSA45.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[(4-bromophenyl)methylamino]cyclobutyl]ethanol
CID 115673951
1-[[(5-chlorofuran-2-yl)methylamino]methyl]cyclobutan-1-ol
CID 115621585
[1-[[(5-chlorofuran-2-yl)methylamino]methyl]cyclopentyl]methanol
CID 115358933
2-[1-[(2-chlorophenyl)methylamino]cyclobutyl]ethanol;hydrochloride
CID 115673948
N-[(5-chlorofuran-2-yl)methyl]-3-methyloxolan-3-amine
CID 115768841
1-(5-chlorofuran-2-yl)-N-[(1-methylcyclobutyl)methyl]methanamine
CID 103735965
1-[[(5-chlorofuran-2-yl)methylamino]methyl]cyclohexan-1-ol
CID 62867945
2-[2-[(5-chlorofuran-2-yl)methylamino]ethoxy]ethanol
CID 60663886
[1-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]cyclobutyl]methanol
CID 115733353
2-[1-[(2-methylphenyl)methylamino]cyclobutyl]ethanol
CID 115673985
[5-[[[1-(hydroxymethyl)cyclopropyl]amino]methyl]furan-2-yl]methanol
CID 115762994
2-[3-[(5-chlorofuran-2-yl)methylamino]propoxy]ethanol
CID 103992501

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol?
The IUPAC name of 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol (CID 115674021) is 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol.
What is the SMILES notation for 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol?
The canonical SMILES for 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol is OCCC1(NCc2ccc(Cl)o2)CCC1.
What is the InChIKey of 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol?
The InChIKey is WYHGKRIHNIPOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClNO2/c12-10-3-2-9(15-10)8-13-11(6-7-14)4-1-5-11/h2-3,13-14H,1,4-8H2.
What are the key properties of 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol?
2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol has a molecular weight of 229.71 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(5-chlorofuran-2-yl)methylamino]cyclobutyl]ethanol is sourced from PubChem (CID 115674021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).