N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide

C15H19FN2O — CID 110469855

IUPACN-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide
SMILESO=C(NC1(c2ccccc2F)CCC1)N1CCCC1
InChIInChI=1S/C15H19FN2O/c16-13-7-2-1-6-12(13)15(8-5-9-15)17-14(19)18-10-3-4-11-18/h1-2,6-7H,3-5,8-11H2,(H,17,19)
InChIKeyFLGBKZKZUIRPQM-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.01
Rot. Bonds2

About N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide

N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide (PubChem CID 110469855) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide
PubChem CID110469855
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC NameN-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide
SMILESO=C(NC1(c2ccccc2F)CCC1)N1CCCC1
InChIInChI=1S/C15H19FN2O/c16-13-7-2-1-6-12(13)15(8-5-9-15)17-14(19)18-10-3-4-11-18/h1-2,6-7H,3-5,8-11H2,(H,17,19)
InChIKeyFLGBKZKZUIRPQM-UHFFFAOYSA-N
XLogP3.01
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide (CID 110469855) is N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide is O=C(NC1(c2ccccc2F)CCC1)N1CCCC1.
What is the InChIKey of N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide?
The InChIKey is FLGBKZKZUIRPQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c16-13-7-2-1-6-12(13)15(8-5-9-15)17-14(19)18-10-3-4-11-18/h1-2,6-7H,3-5,8-11H2,(H,17,19).
What are the key properties of N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide?
N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide has a molecular weight of 262.33 g/mol, XLogP of 3.01, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-fluorophenyl)cyclobutyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 110469855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).