2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide

C20H23FN2O3 — CID 154794863

IUPAC2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide
SMILESCOc1ccc(-c2ccc(C(=O)NCCN3CCOCC3)c(F)c2)cc1
InChIInChI=1S/C20H23FN2O3/c1-25-17-5-2-15(3-6-17)16-4-7-18(19(21)14-16)20(24)22-8-9-23-10-12-26-13-11-23/h2-7,14H,8-13H2,1H3,(H,22,24)
InChIKeyYAQWEHQUPSTBOM-UHFFFAOYSA-N
MW358.41 g/mol
LogP2.56
Rot. Bonds6

About 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide

2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 154794863) has the molecular formula C20H23FN2O3 and a molecular weight of 358.41 g/mol. Its IUPAC name is 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID154794863
Molecular FormulaC20H23FN2O3
Molecular Weight358.41 g/mol
Exact Mass358.17
IUPAC Name2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide
SMILESCOc1ccc(-c2ccc(C(=O)NCCN3CCOCC3)c(F)c2)cc1
InChIInChI=1S/C20H23FN2O3/c1-25-17-5-2-15(3-6-17)16-4-7-18(19(21)14-16)20(24)22-8-9-23-10-12-26-13-11-23/h2-7,14H,8-13H2,1H3,(H,22,24)
InChIKeyYAQWEHQUPSTBOM-UHFFFAOYSA-N
XLogP2.56
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.41
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide (CID 154794863) is 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide is COc1ccc(-c2ccc(C(=O)NCCN3CCOCC3)c(F)c2)cc1.
What is the InChIKey of 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is YAQWEHQUPSTBOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O3/c1-25-17-5-2-15(3-6-17)16-4-7-18(19(21)14-16)20(24)22-8-9-23-10-12-26-13-11-23/h2-7,14H,8-13H2,1H3,(H,22,24).
What are the key properties of 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide?
2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 358.41 g/mol, XLogP of 2.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 154794863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).