N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide

C19H17F3N2O3 — CID 15994190

IUPACN-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CCCO2)cc1
InChIInChI=1S/C19H17F3N2O3/c20-19(21,22)13-5-9-15(10-6-13)23-17(25)12-3-7-14(8-4-12)24-18(26)16-2-1-11-27-16/h3-10,16H,1-2,11H2,(H,23,25)(H,24,26)
InChIKeyYAUQYLJPVWIDHL-UHFFFAOYSA-N
MW378.35 g/mol
LogP4.08
Rot. Bonds4

About N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide

N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide (PubChem CID 15994190) has the molecular formula C19H17F3N2O3 and a molecular weight of 378.35 g/mol. Its IUPAC name is N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide
PubChem CID15994190
Molecular FormulaC19H17F3N2O3
Molecular Weight378.35 g/mol
Exact Mass378.12
IUPAC NameN-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CCCO2)cc1
InChIInChI=1S/C19H17F3N2O3/c20-19(21,22)13-5-9-15(10-6-13)23-17(25)12-3-7-14(8-4-12)24-18(26)16-2-1-11-27-16/h3-10,16H,1-2,11H2,(H,23,25)(H,24,26)
InChIKeyYAUQYLJPVWIDHL-UHFFFAOYSA-N
XLogP4.08
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.35
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide (CID 15994190) is N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide is O=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(NC(=O)C2CCCO2)cc1.
What is the InChIKey of N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide?
The InChIKey is YAUQYLJPVWIDHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F3N2O3/c20-19(21,22)13-5-9-15(10-6-13)23-17(25)12-3-7-14(8-4-12)24-18(26)16-2-1-11-27-16/h3-10,16H,1-2,11H2,(H,23,25)(H,24,26).
What are the key properties of N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide?
N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide has a molecular weight of 378.35 g/mol, XLogP of 4.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[4-(trifluoromethyl)phenyl]carbamoyl]phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 15994190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).