N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide

C11H11ClFNO2 — CID 4218317

IUPACN-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1F)C1CCCO1
InChIInChI=1S/C11H11ClFNO2/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)
InChIKeyUAHCXMMEQZCSHC-UHFFFAOYSA-N
MW243.66 g/mol
LogP2.60
Rot. Bonds2

About N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide

N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide (PubChem CID 4218317) has the molecular formula C11H11ClFNO2 and a molecular weight of 243.66 g/mol. Its IUPAC name is N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide
PubChem CID4218317
Molecular FormulaC11H11ClFNO2
Molecular Weight243.66 g/mol
Exact Mass243.05
IUPAC NameN-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1F)C1CCCO1
InChIInChI=1S/C11H11ClFNO2/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)
InChIKeyUAHCXMMEQZCSHC-UHFFFAOYSA-N
XLogP2.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.66
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide?
The IUPAC name of N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide (CID 4218317) is N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide?
The canonical SMILES for N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide is O=C(Nc1ccc(Cl)cc1F)C1CCCO1.
What is the InChIKey of N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide?
The InChIKey is UAHCXMMEQZCSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClFNO2/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-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide?
N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide has a molecular weight of 243.66 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-fluorophenyl)oxolane-2-carboxamide is sourced from PubChem (CID 4218317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).