N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide

C16H15FN2O — CID 47034423

IUPACN-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide
SMILESO=C(Nc1ccc(F)cc1)N1CCC1c1ccccc1
InChIInChI=1S/C16H15FN2O/c17-13-6-8-14(9-7-13)18-16(20)19-11-10-15(19)12-4-2-1-3-5-12/h1-9,15H,10-11H2,(H,18,20)
InChIKeyGOPNRLPIQHBHMO-UHFFFAOYSA-N
MW270.31 g/mol
LogP3.80
Rot. Bonds2

About N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide

N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide (PubChem CID 47034423) has the molecular formula C16H15FN2O and a molecular weight of 270.31 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide
PubChem CID47034423
Molecular FormulaC16H15FN2O
Molecular Weight270.31 g/mol
Exact Mass270.12
IUPAC NameN-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide
SMILESO=C(Nc1ccc(F)cc1)N1CCC1c1ccccc1
InChIInChI=1S/C16H15FN2O/c17-13-6-8-14(9-7-13)18-16(20)19-11-10-15(19)12-4-2-1-3-5-12/h1-9,15H,10-11H2,(H,18,20)
InChIKeyGOPNRLPIQHBHMO-UHFFFAOYSA-N
XLogP3.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide (CID 47034423) is N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide is O=C(Nc1ccc(F)cc1)N1CCC1c1ccccc1.
What is the InChIKey of N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide?
The InChIKey is GOPNRLPIQHBHMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O/c17-13-6-8-14(9-7-13)18-16(20)19-11-10-15(19)12-4-2-1-3-5-12/h1-9,15H,10-11H2,(H,18,20).
What are the key properties of N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide?
N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide has a molecular weight of 270.31 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-phenylazetidine-1-carboxamide is sourced from PubChem (CID 47034423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).