2-fluoro-N-(3-phenylcyclobutyl)aniline

C16H16FN — CID 43632160

IUPAC2-fluoro-N-(3-phenylcyclobutyl)aniline
SMILESFc1ccccc1NC1CC(c2ccccc2)C1
InChIInChI=1S/C16H16FN/c17-15-8-4-5-9-16(15)18-14-10-13(11-14)12-6-2-1-3-7-12/h1-9,13-14,18H,10-11H2
InChIKeyFVYJUJMWQALTDF-UHFFFAOYSA-N
MW241.31 g/mol
LogP4.18
Rot. Bonds3

About 2-fluoro-N-(3-phenylcyclobutyl)aniline

2-fluoro-N-(3-phenylcyclobutyl)aniline (PubChem CID 43632160) has the molecular formula C16H16FN and a molecular weight of 241.31 g/mol. Its IUPAC name is 2-fluoro-N-(3-phenylcyclobutyl)aniline.

Molecular Properties

Compound Name2-fluoro-N-(3-phenylcyclobutyl)aniline
PubChem CID43632160
Molecular FormulaC16H16FN
Molecular Weight241.31 g/mol
Exact Mass241.13
IUPAC Name2-fluoro-N-(3-phenylcyclobutyl)aniline
SMILESFc1ccccc1NC1CC(c2ccccc2)C1
InChIInChI=1S/C16H16FN/c17-15-8-4-5-9-16(15)18-14-10-13(11-14)12-6-2-1-3-7-12/h1-9,13-14,18H,10-11H2
InChIKeyFVYJUJMWQALTDF-UHFFFAOYSA-N
XLogP4.18
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[3-(4-chlorophenyl)cyclobutyl]-2-fluoroaniline
CID 43633620
2,3,5-trifluoro-N-(3-phenylcyclobutyl)aniline
CID 62810502
2-iodo-N-(3-phenylcyclobutyl)aniline
CID 43632290
N-(2-fluorophenyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 105476083
4-fluoro-N-(3-phenylcyclobutyl)aniline
CID 43632156
2-[(3-phenylcyclobutyl)amino]benzoic acid
CID 43632305
5-chloro-N-[3-(3-chlorophenyl)cyclobutyl]-2-fluoroaniline
CID 43635416
2-methylsulfonyl-N-(3-phenylcyclobutyl)aniline
CID 43724687
N-(3-phenylcyclobutyl)-5,6,7,8-tetrahydronaphthalen-1-amine
CID 43632103
2-fluoro-5-methyl-N-[3-(3-methylphenyl)cyclobutyl]aniline
CID 43634988
2-bromo-N-[3-(2-fluorophenyl)cyclobutyl]aniline
CID 43633514
2,5-difluoro-N-(4-phenylcyclohexyl)aniline
CID 29275617

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(3-phenylcyclobutyl)aniline?
The IUPAC name of 2-fluoro-N-(3-phenylcyclobutyl)aniline (CID 43632160) is 2-fluoro-N-(3-phenylcyclobutyl)aniline.
What is the SMILES notation for 2-fluoro-N-(3-phenylcyclobutyl)aniline?
The canonical SMILES for 2-fluoro-N-(3-phenylcyclobutyl)aniline is Fc1ccccc1NC1CC(c2ccccc2)C1.
What is the InChIKey of 2-fluoro-N-(3-phenylcyclobutyl)aniline?
The InChIKey is FVYJUJMWQALTDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN/c17-15-8-4-5-9-16(15)18-14-10-13(11-14)12-6-2-1-3-7-12/h1-9,13-14,18H,10-11H2.
What are the key properties of 2-fluoro-N-(3-phenylcyclobutyl)aniline?
2-fluoro-N-(3-phenylcyclobutyl)aniline has a molecular weight of 241.31 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(3-phenylcyclobutyl)aniline is sourced from PubChem (CID 43632160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).