2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide

C19H21BrN2O2 — CID 78791630

IUPAC2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide
SMILESCC(C)C(C)NC(=O)c1ccccc1NC(=O)c1ccccc1Br
InChIInChI=1S/C19H21BrN2O2/c1-12(2)13(3)21-19(24)15-9-5-7-11-17(15)22-18(23)14-8-4-6-10-16(14)20/h4-13H,1-3H3,(H,21,24)(H,22,23)
InChIKeyFFTDMYNCLJXFLZ-UHFFFAOYSA-N
MW389.29 g/mol
LogP4.48
Rot. Bonds5

About 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide

2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide (PubChem CID 78791630) has the molecular formula C19H21BrN2O2 and a molecular weight of 389.29 g/mol. Its IUPAC name is 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide
PubChem CID78791630
Molecular FormulaC19H21BrN2O2
Molecular Weight389.29 g/mol
Exact Mass388.08
IUPAC Name2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide
SMILESCC(C)C(C)NC(=O)c1ccccc1NC(=O)c1ccccc1Br
InChIInChI=1S/C19H21BrN2O2/c1-12(2)13(3)21-19(24)15-9-5-7-11-17(15)22-18(23)14-8-4-6-10-16(14)20/h4-13H,1-3H3,(H,21,24)(H,22,23)
InChIKeyFFTDMYNCLJXFLZ-UHFFFAOYSA-N
XLogP4.48
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.29
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-bromobenzoyl)amino]-N-(1-phenylethyl)benzamide
CID 4935078
1-N,2-N-bis[(2R)-3-methylbutan-2-yl]benzene-1,2-dicarboxamide
CID 786717
methyl 2-[(2-bromobenzoyl)amino]benzoate
CID 723592
2-[(2-bromobenzoyl)amino]-N-(4-bromophenyl)benzamide
CID 55358520
2,5-dibromo-1-N,4-N-bis(3-methylbutan-2-yl)benzene-1,4-dicarboxamide
CID 42908120
2-[(2-bromobenzoyl)amino]-N-[4-(dimethylamino)phenyl]benzamide
CID 78791161
2-[(2-bromobenzoyl)amino]-N-(4-ethylphenyl)benzamide
CID 1313742
2-bromo-N-(2-methoxyphenyl)benzamide
CID 676344
2-bromo-N-(1-bromo-3-methylbutan-2-yl)benzamide
CID 114315987
2-bromo-N-[2-[(1S)-1-hydroxypropyl]phenyl]benzamide
CID 7337857
2-bromo-N-[1-(2-bromophenyl)ethyl]benzamide
CID 42998507
2-bromo-N-(2-fluoro-3-methylphenyl)benzamide
CID 113351864

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide?
The IUPAC name of 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide (CID 78791630) is 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide.
What is the SMILES notation for 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide?
The canonical SMILES for 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide is CC(C)C(C)NC(=O)c1ccccc1NC(=O)c1ccccc1Br.
What is the InChIKey of 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide?
The InChIKey is FFTDMYNCLJXFLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21BrN2O2/c1-12(2)13(3)21-19(24)15-9-5-7-11-17(15)22-18(23)14-8-4-6-10-16(14)20/h4-13H,1-3H3,(H,21,24)(H,22,23).
What are the key properties of 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide?
2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide has a molecular weight of 389.29 g/mol, XLogP of 4.48, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromobenzoyl)amino]-N-(3-methylbutan-2-yl)benzamide is sourced from PubChem (CID 78791630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).