N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide

C15H20FNO2 — CID 55162488

IUPACN-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide
SMILESCCN(CC1CCOC1)C(=O)c1ccc(F)c(C)c1
InChIInChI=1S/C15H20FNO2/c1-3-17(9-12-6-7-19-10-12)15(18)13-4-5-14(16)11(2)8-13/h4-5,8,12H,3,6-7,9-10H2,1-2H3
InChIKeyKHQJOAUMHUPZJK-UHFFFAOYSA-N
MW265.33 g/mol
LogP2.63
Rot. Bonds4

About N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide

N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide (PubChem CID 55162488) has the molecular formula C15H20FNO2 and a molecular weight of 265.33 g/mol. Its IUPAC name is N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide.

Molecular Properties

Compound NameN-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide
PubChem CID55162488
Molecular FormulaC15H20FNO2
Molecular Weight265.33 g/mol
Exact Mass265.15
IUPAC NameN-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide
SMILESCCN(CC1CCOC1)C(=O)c1ccc(F)c(C)c1
InChIInChI=1S/C15H20FNO2/c1-3-17(9-12-6-7-19-10-12)15(18)13-4-5-14(16)11(2)8-13/h4-5,8,12H,3,6-7,9-10H2,1-2H3
InChIKeyKHQJOAUMHUPZJK-UHFFFAOYSA-N
XLogP2.63
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide?
The IUPAC name of N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide (CID 55162488) is N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide.
What is the SMILES notation for N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide?
The canonical SMILES for N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide is CCN(CC1CCOC1)C(=O)c1ccc(F)c(C)c1.
What is the InChIKey of N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide?
The InChIKey is KHQJOAUMHUPZJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO2/c1-3-17(9-12-6-7-19-10-12)15(18)13-4-5-14(16)11(2)8-13/h4-5,8,12H,3,6-7,9-10H2,1-2H3.
What are the key properties of N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide?
N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide has a molecular weight of 265.33 g/mol, XLogP of 2.63, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-fluoro-3-methyl-N-(oxolan-3-ylmethyl)benzamide is sourced from PubChem (CID 55162488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).