N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine

C18H20FN — CID 43632093

IUPACN-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine
SMILESFc1ccc(CCNC2CC(c3ccccc3)C2)cc1
InChIInChI=1S/C18H20FN/c19-17-8-6-14(7-9-17)10-11-20-18-12-16(13-18)15-4-2-1-3-5-15/h1-9,16,18,20H,10-13H2
InChIKeyHHESATIKAGWWSH-UHFFFAOYSA-N
MW269.36 g/mol
LogP3.90
Rot. Bonds5

About N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine

N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine (PubChem CID 43632093) has the molecular formula C18H20FN and a molecular weight of 269.36 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine
PubChem CID43632093
Molecular FormulaC18H20FN
Molecular Weight269.36 g/mol
Exact Mass269.16
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine
SMILESFc1ccc(CCNC2CC(c3ccccc3)C2)cc1
InChIInChI=1S/C18H20FN/c19-17-8-6-14(7-9-17)10-11-20-18-12-16(13-18)15-4-2-1-3-5-15/h1-9,16,18,20H,10-13H2
InChIKeyHHESATIKAGWWSH-UHFFFAOYSA-N
XLogP3.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.36
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

benzyl N-[3-[2-(4-fluorophenyl)ethylamino]cyclobutyl]carbamate
CID 103392750
N-[2-(cyclohexen-1-yl)ethyl]-3-(4-fluorophenyl)cyclobutan-1-amine
CID 43634059
N-[1-(4-fluorophenyl)propan-2-yl]-3-phenylcyclobutan-1-amine
CID 62996135
4-fluoro-N-(3-phenylcyclobutyl)aniline
CID 43632156
3-phenyl-N-(4,4,4-trifluorobutyl)cyclobutan-1-amine
CID 115516339
3-(4-bromophenyl)-N-[2-(4-chlorophenyl)ethyl]cyclobutan-1-amine
CID 43634135
3-(4-chlorophenyl)-N-(3-phenylpropyl)cyclobutan-1-amine
CID 43634161
3-(4-fluorophenyl)-N-[2-(1,3-thiazol-2-yl)ethyl]cyclobutan-1-amine
CID 63242564
3-[(3-phenylcyclobutyl)amino]propanenitrile
CID 43632270
N-[2-(4-fluorophenyl)ethyl]-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 43222915
2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol
CID 43635434
2-[[3-(4-fluorophenyl)cyclobutyl]amino]acetic acid
CID 43635152

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine (CID 43632093) is N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine is Fc1ccc(CCNC2CC(c3ccccc3)C2)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine?
The InChIKey is HHESATIKAGWWSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN/c19-17-8-6-14(7-9-17)10-11-20-18-12-16(13-18)15-4-2-1-3-5-15/h1-9,16,18,20H,10-13H2.
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine?
N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine has a molecular weight of 269.36 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine is sourced from PubChem (CID 43632093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).