4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide

C15H19BrFNO2 — CID 60793269

IUPAC4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide
SMILESCOCCN(C(=O)c1ccc(Br)cc1F)C(C)C1CC1
InChIInChI=1S/C15H19BrFNO2/c1-10(11-3-4-11)18(7-8-20-2)15(19)13-6-5-12(16)9-14(13)17/h5-6,9-11H,3-4,7-8H2,1-2H3
InChIKeyYNZPJOKJHCZZDG-UHFFFAOYSA-N
MW344.22 g/mol
LogP3.48
Rot. Bonds6

About 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide

4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide (PubChem CID 60793269) has the molecular formula C15H19BrFNO2 and a molecular weight of 344.22 g/mol. Its IUPAC name is 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide
PubChem CID60793269
Molecular FormulaC15H19BrFNO2
Molecular Weight344.22 g/mol
Exact Mass343.06
IUPAC Name4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide
SMILESCOCCN(C(=O)c1ccc(Br)cc1F)C(C)C1CC1
InChIInChI=1S/C15H19BrFNO2/c1-10(11-3-4-11)18(7-8-20-2)15(19)13-6-5-12(16)9-14(13)17/h5-6,9-11H,3-4,7-8H2,1-2H3
InChIKeyYNZPJOKJHCZZDG-UHFFFAOYSA-N
XLogP3.48
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.22
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclopropylethyl)-3-fluoro-N-(2-methoxyethyl)pyridine-4-carboxamide
CID 115645950
5-amino-2-bromo-N-(1-cyclopropylethyl)-4-fluoro-N-(2-methoxyethyl)benzamide
CID 62816823
5-amino-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)-3-methylbenzamide
CID 103296114
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-4-sulfanylbenzamide
CID 107026569
3-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)thiophene-2-carboxamide
CID 60794133
N-(1-cyclopropylethyl)-N-(2-methoxyethyl)benzamide
CID 60794981
4,5-dibromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)thiophene-2-carboxamide
CID 112729543
6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 103889771
2-amino-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)-3-methylbenzamide
CID 61108147
4-bromo-N-butan-2-yl-N-ethyl-2-fluorobenzamide
CID 43274768
2-bromo-4-fluoro-N-(2-methoxyethyl)-N-propan-2-ylbenzamide
CID 82951741
4-bromo-2-[1-cyclopropylethyl(2-methoxyethyl)amino]benzenecarbothioamide
CID 114903023

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide?
The IUPAC name of 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide (CID 60793269) is 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide is COCCN(C(=O)c1ccc(Br)cc1F)C(C)C1CC1.
What is the InChIKey of 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide?
The InChIKey is YNZPJOKJHCZZDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19BrFNO2/c1-10(11-3-4-11)18(7-8-20-2)15(19)13-6-5-12(16)9-14(13)17/h5-6,9-11H,3-4,7-8H2,1-2H3.
What are the key properties of 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide?
4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide has a molecular weight of 344.22 g/mol, XLogP of 3.48, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(1-cyclopropylethyl)-2-fluoro-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 60793269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).