4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide

C15H20FNO2 — CID 27456585

IUPAC4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide
SMILESCC(C)NC(=O)C1(c2ccc(F)cc2)CCOCC1
InChIInChI=1S/C15H20FNO2/c1-11(2)17-14(18)15(7-9-19-10-8-15)12-3-5-13(16)6-4-12/h3-6,11H,7-10H2,1-2H3,(H,17,18)
InChIKeyUKOVPJGEZURCKR-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.40
Rot. Bonds3

About 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide

4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide (PubChem CID 27456585) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide
PubChem CID27456585
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC Name4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide
SMILESCC(C)NC(=O)C1(c2ccc(F)cc2)CCOCC1
InChIInChI=1S/C15H20FNO2/c1-11(2)17-14(18)15(7-9-19-10-8-15)12-3-5-13(16)6-4-12/h3-6,11H,7-10H2,1-2H3,(H,17,18)
InChIKeyUKOVPJGEZURCKR-UHFFFAOYSA-N
XLogP2.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide?
The IUPAC name of 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide (CID 27456585) is 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide.
What is the SMILES notation for 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide?
The canonical SMILES for 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide is CC(C)NC(=O)C1(c2ccc(F)cc2)CCOCC1.
What is the InChIKey of 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide?
The InChIKey is UKOVPJGEZURCKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-11(2)17-14(18)15(7-9-19-10-8-15)12-3-5-13(16)6-4-12/h3-6,11H,7-10H2,1-2H3,(H,17,18).
What are the key properties of 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide?
4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide has a molecular weight of 265.33 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-propan-2-yloxane-4-carboxamide is sourced from PubChem (CID 27456585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).