N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide

C20H17FN2O3S — CID 57404885

IUPACN-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide
SMILESO=S(=O)(Nc1cccc(-c2ccc(Oc3ccc(F)cc3)cc2)n1)C1CC1
InChIInChI=1S/C20H17FN2O3S/c21-15-6-10-17(11-7-15)26-16-8-4-14(5-9-16)19-2-1-3-20(22-19)23-27(24,25)18-12-13-18/h1-11,18H,12-13H2,(H,22,23)
InChIKeyCAJGZYDAWGNVNQ-UHFFFAOYSA-N
MW384.43 g/mol
LogP4.58
Rot. Bonds6

About N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide

N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide (PubChem CID 57404885) has the molecular formula C20H17FN2O3S and a molecular weight of 384.43 g/mol. Its IUPAC name is N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide
PubChem CID57404885
Molecular FormulaC20H17FN2O3S
Molecular Weight384.43 g/mol
Exact Mass384.09
IUPAC NameN-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide
SMILESO=S(=O)(Nc1cccc(-c2ccc(Oc3ccc(F)cc3)cc2)n1)C1CC1
InChIInChI=1S/C20H17FN2O3S/c21-15-6-10-17(11-7-15)26-16-8-4-14(5-9-16)19-2-1-3-20(22-19)23-27(24,25)18-12-13-18/h1-11,18H,12-13H2,(H,22,23)
InChIKeyCAJGZYDAWGNVNQ-UHFFFAOYSA-N
XLogP4.58
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.43
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide?
The IUPAC name of N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide (CID 57404885) is N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide.
What is the SMILES notation for N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide?
The canonical SMILES for N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide is O=S(=O)(Nc1cccc(-c2ccc(Oc3ccc(F)cc3)cc2)n1)C1CC1.
What is the InChIKey of N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide?
The InChIKey is CAJGZYDAWGNVNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O3S/c21-15-6-10-17(11-7-15)26-16-8-4-14(5-9-16)19-2-1-3-20(22-19)23-27(24,25)18-12-13-18/h1-11,18H,12-13H2,(H,22,23).
What are the key properties of N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide?
N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide has a molecular weight of 384.43 g/mol, XLogP of 4.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-(4-fluorophenoxy)phenyl]-2-pyridinyl]cyclopropanesulfonamide is sourced from PubChem (CID 57404885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).