3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine

C16H18FNO — CID 43635483

IUPAC3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine
SMILESFc1ccccc1C1CC(NCCc2ccco2)C1
InChIInChI=1S/C16H18FNO/c17-16-6-2-1-5-15(16)12-10-13(11-12)18-8-7-14-4-3-9-19-14/h1-6,9,12-13,18H,7-8,10-11H2
InChIKeyBMOFTJBWTOWXTJ-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.50
Rot. Bonds5

About 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine

3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine (PubChem CID 43635483) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine
PubChem CID43635483
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine
SMILESFc1ccccc1C1CC(NCCc2ccco2)C1
InChIInChI=1S/C16H18FNO/c17-16-6-2-1-5-15(16)12-10-13(11-12)18-8-7-14-4-3-9-19-14/h1-6,9,12-13,18H,7-8,10-11H2
InChIKeyBMOFTJBWTOWXTJ-UHFFFAOYSA-N
XLogP3.50
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-bromophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine
CID 43635490
3-(2-fluorophenyl)-N-[2-(3-fluorophenyl)ethyl]cyclobutan-1-amine
CID 43635646
N-[2-(furan-2-yl)ethyl]-3-methoxycyclobutan-1-amine
CID 104870790
N-[2-(furan-2-yl)ethyl]-4-phenylcyclohexan-1-amine
CID 43395503
5-[[3-(2-fluorophenyl)cyclobutyl]amino]pentanamide
CID 106233343
3-N-[2-(furan-2-yl)ethyl]cyclopentane-1,3-diamine
CID 79462115
3-(2-bromophenyl)-N-[2-(2-fluorophenyl)ethyl]cyclobutan-1-amine
CID 43633263
3-(2-fluorophenyl)-N-(7-methyloctyl)cyclobutan-1-amine
CID 43634781
N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine
CID 43632427
methyl 4-[[3-(2-fluorophenyl)cyclobutyl]amino]butanoate
CID 60782595
(1R,3S)-3-[[3-(2-fluorophenyl)cyclobutyl]amino]-1-(furan-2-yl)butan-1-ol
CID 99621655
3-[[3-(2-fluorophenyl)cyclobutyl]amino]-1-pyrrolidin-1-ylpropan-1-one
CID 43634310

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine?
The IUPAC name of 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine (CID 43635483) is 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine.
What is the SMILES notation for 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine?
The canonical SMILES for 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine is Fc1ccccc1C1CC(NCCc2ccco2)C1.
What is the InChIKey of 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine?
The InChIKey is BMOFTJBWTOWXTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c17-16-6-2-1-5-15(16)12-10-13(11-12)18-8-7-14-4-3-9-19-14/h1-6,9,12-13,18H,7-8,10-11H2.
What are the key properties of 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine?
3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine has a molecular weight of 259.32 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]cyclobutan-1-amine is sourced from PubChem (CID 43635483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).