2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide

C10H10FNO3 — CID 69363262

IUPAC2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide
SMILESNC(=O)C1(c2ccc(F)cc2)OCCO1
InChIInChI=1S/C10H10FNO3/c11-8-3-1-7(2-4-8)10(9(12)13)14-5-6-15-10/h1-4H,5-6H2,(H2,12,13)
InChIKeyKIDJPOCXPNGQIO-UHFFFAOYSA-N
MW211.19 g/mol
LogP0.51
Rot. Bonds2

About 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide

2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide (PubChem CID 69363262) has the molecular formula C10H10FNO3 and a molecular weight of 211.19 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide
PubChem CID69363262
Molecular FormulaC10H10FNO3
Molecular Weight211.19 g/mol
Exact Mass211.06
IUPAC Name2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide
SMILESNC(=O)C1(c2ccc(F)cc2)OCCO1
InChIInChI=1S/C10H10FNO3/c11-8-3-1-7(2-4-8)10(9(12)13)14-5-6-15-10/h1-4H,5-6H2,(H2,12,13)
InChIKeyKIDJPOCXPNGQIO-UHFFFAOYSA-N
XLogP0.51
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.19
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide?
The IUPAC name of 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide (CID 69363262) is 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide.
What is the SMILES notation for 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide?
The canonical SMILES for 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide is NC(=O)C1(c2ccc(F)cc2)OCCO1.
What is the InChIKey of 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide?
The InChIKey is KIDJPOCXPNGQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO3/c11-8-3-1-7(2-4-8)10(9(12)13)14-5-6-15-10/h1-4H,5-6H2,(H2,12,13).
What are the key properties of 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide?
2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide has a molecular weight of 211.19 g/mol, XLogP of 0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1,3-dioxolane-2-carboxamide is sourced from PubChem (CID 69363262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).