3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine

C17H19FN2 — CID 43634317

IUPAC3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine
SMILESCC(NC1CC(c2ccc(F)cc2)C1)c1cccnc1
InChIInChI=1S/C17H19FN2/c1-12(14-3-2-8-19-11-14)20-17-9-15(10-17)13-4-6-16(18)7-5-13/h2-8,11-12,15,17,20H,9-10H2,1H3
InChIKeyZJERODXFYOKCFQ-UHFFFAOYSA-N
MW270.35 g/mol
LogP3.82
Rot. Bonds4

About 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine

3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine (PubChem CID 43634317) has the molecular formula C17H19FN2 and a molecular weight of 270.35 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine
PubChem CID43634317
Molecular FormulaC17H19FN2
Molecular Weight270.35 g/mol
Exact Mass270.15
IUPAC Name3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine
SMILESCC(NC1CC(c2ccc(F)cc2)C1)c1cccnc1
InChIInChI=1S/C17H19FN2/c1-12(14-3-2-8-19-11-14)20-17-9-15(10-17)13-4-6-16(18)7-5-13/h2-8,11-12,15,17,20H,9-10H2,1H3
InChIKeyZJERODXFYOKCFQ-UHFFFAOYSA-N
XLogP3.82
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenyl-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine
CID 43632220
3-(4-fluorophenyl)-N-[(1R)-1-(4-fluorophenyl)ethyl]cyclobutan-1-amine
CID 81351603
3-(4-fluorophenyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclobutan-1-amine
CID 81369914
N-[(1S)-1-pyridin-3-ylethyl]cyclopropanamine
CID 26385082
3-(4-fluorophenyl)-N-[1-(4-methylphenyl)ethyl]cyclobutan-1-amine
CID 60946183
N-[(1S)-1-pyridin-3-ylethyl]azetidin-3-amine
CID 81406806
N-(1-pyridin-3-ylethyl)cyclododecanamine
CID 43079395
N-[(1S)-1-pyridin-3-ylethyl]cycloheptanamine
CID 28646604
1-(4-fluorophenyl)-N-[(1R)-1-pyridin-3-ylethyl]ethanamine
CID 81406480
3-(4-fluorophenyl)-N-[(1R)-1-(2-fluorophenyl)ethyl]cyclobutan-1-amine
CID 81370958
3-N-[(1S)-1-pyridin-3-ylethyl]cyclopentane-1,3-diamine
CID 81406551
N-(1-pyridin-3-ylethyl)pyrrolidin-3-amine
CID 79724749

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine?
The IUPAC name of 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine (CID 43634317) is 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine.
What is the SMILES notation for 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine?
The canonical SMILES for 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine is CC(NC1CC(c2ccc(F)cc2)C1)c1cccnc1.
What is the InChIKey of 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine?
The InChIKey is ZJERODXFYOKCFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2/c1-12(14-3-2-8-19-11-14)20-17-9-15(10-17)13-4-6-16(18)7-5-13/h2-8,11-12,15,17,20H,9-10H2,1H3.
What are the key properties of 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine?
3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine has a molecular weight of 270.35 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-N-(1-pyridin-3-ylethyl)cyclobutan-1-amine is sourced from PubChem (CID 43634317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).