2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide

C10H11BrN2O2 — CID 18106416

IUPAC2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide
SMILESCNC(=O)CNC(=O)c1ccccc1Br
InChIInChI=1S/C10H11BrN2O2/c1-12-9(14)6-13-10(15)7-4-2-3-5-8(7)11/h2-5H,6H2,1H3,(H,12,14)(H,13,15)
InChIKeyXCJUJJYGURHHQP-UHFFFAOYSA-N
MW271.11 g/mol
LogP0.92
Rot. Bonds3

About 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide

2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide (PubChem CID 18106416) has the molecular formula C10H11BrN2O2 and a molecular weight of 271.11 g/mol. Its IUPAC name is 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide
PubChem CID18106416
Molecular FormulaC10H11BrN2O2
Molecular Weight271.11 g/mol
Exact Mass270.00
IUPAC Name2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide
SMILESCNC(=O)CNC(=O)c1ccccc1Br
InChIInChI=1S/C10H11BrN2O2/c1-12-9(14)6-13-10(15)7-4-2-3-5-8(7)11/h2-5H,6H2,1H3,(H,12,14)(H,13,15)
InChIKeyXCJUJJYGURHHQP-UHFFFAOYSA-N
XLogP0.92
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.11
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 18162727
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methyl 2-[[2-[(2-bromobenzoyl)amino]acetyl]amino]benzoate
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2-bromo-N-[2-oxo-2-[2-(1-phenylethylidene)hydrazinyl]ethyl]benzamide
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2-bromo-N-[2-[(4-hydroxy-2-methylbutyl)amino]-2-oxoethyl]benzamide
CID 66108423
2-[2-(methylamino)ethyl]-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 104547416
2-bromo-N-[2-oxo-2-[(2E)-2-pentan-2-ylidenehydrazinyl]ethyl]benzamide
CID 171980714
4-bromo-2-hydroxy-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 47435886
2-bromo-N-[2-oxo-2-[(3,3,3-trifluoro-2-hydroxypropyl)amino]ethyl]benzamide
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1-[(2-bromobenzoyl)amino]-3-methylurea
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CID 108571223

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide?
The IUPAC name of 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide (CID 18106416) is 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide.
What is the SMILES notation for 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide?
The canonical SMILES for 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide is CNC(=O)CNC(=O)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide?
The InChIKey is XCJUJJYGURHHQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2O2/c1-12-9(14)6-13-10(15)7-4-2-3-5-8(7)11/h2-5H,6H2,1H3,(H,12,14)(H,13,15).
What are the key properties of 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide?
2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide has a molecular weight of 271.11 g/mol, XLogP of 0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-[2-(methylamino)-2-oxoethyl]benzamide is sourced from PubChem (CID 18106416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).