N-(2,4-difluorophenyl)oxolane-2-carboxamide

C11H11F2NO2 — CID 3155123

IUPACN-(2,4-difluorophenyl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)C1CCCO1
InChIInChI=1S/C11H11F2NO2/c12-7-3-4-9(8(13)6-7)14-11(15)10-2-1-5-16-10/h3-4,6,10H,1-2,5H2,(H,14,15)
InChIKeyWQLUHPVQWCBGFK-UHFFFAOYSA-N
MW227.21 g/mol
LogP2.08
Rot. Bonds2

About N-(2,4-difluorophenyl)oxolane-2-carboxamide

N-(2,4-difluorophenyl)oxolane-2-carboxamide (PubChem CID 3155123) has the molecular formula C11H11F2NO2 and a molecular weight of 227.21 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)oxolane-2-carboxamide
PubChem CID3155123
Molecular FormulaC11H11F2NO2
Molecular Weight227.21 g/mol
Exact Mass227.08
IUPAC NameN-(2,4-difluorophenyl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)C1CCCO1
InChIInChI=1S/C11H11F2NO2/c12-7-3-4-9(8(13)6-7)14-11(15)10-2-1-5-16-10/h3-4,6,10H,1-2,5H2,(H,14,15)
InChIKeyWQLUHPVQWCBGFK-UHFFFAOYSA-N
XLogP2.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.21
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)oxolane-2-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)oxolane-2-carboxamide (CID 3155123) is N-(2,4-difluorophenyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)oxolane-2-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)oxolane-2-carboxamide is O=C(Nc1ccc(F)cc1F)C1CCCO1.
What is the InChIKey of N-(2,4-difluorophenyl)oxolane-2-carboxamide?
The InChIKey is WQLUHPVQWCBGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2NO2/c12-7-3-4-9(8(13)6-7)14-11(15)10-2-1-5-16-10/h3-4,6,10H,1-2,5H2,(H,14,15).
What are the key properties of N-(2,4-difluorophenyl)oxolane-2-carboxamide?
N-(2,4-difluorophenyl)oxolane-2-carboxamide has a molecular weight of 227.21 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)oxolane-2-carboxamide is sourced from PubChem (CID 3155123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).