5-bromo-2-propan-2-yloxybenzamide

C10H12BrNO2 — CID 17052192

IUPAC5-bromo-2-propan-2-yloxybenzamide
SMILESCC(C)Oc1ccc(Br)cc1C(N)=O
InChIInChI=1S/C10H12BrNO2/c1-6(2)14-9-4-3-7(11)5-8(9)10(12)13/h3-6H,1-2H3,(H2,12,13)
InChIKeyFDRBYSYMMZOUQS-UHFFFAOYSA-N
MW258.12 g/mol
LogP2.34
Rot. Bonds3

About 5-bromo-2-propan-2-yloxybenzamide

5-bromo-2-propan-2-yloxybenzamide (PubChem CID 17052192) has the molecular formula C10H12BrNO2 and a molecular weight of 258.12 g/mol. Its IUPAC name is 5-bromo-2-propan-2-yloxybenzamide.

Molecular Properties

Compound Name5-bromo-2-propan-2-yloxybenzamide
PubChem CID17052192
Molecular FormulaC10H12BrNO2
Molecular Weight258.12 g/mol
Exact Mass257.01
IUPAC Name5-bromo-2-propan-2-yloxybenzamide
SMILESCC(C)Oc1ccc(Br)cc1C(N)=O
InChIInChI=1S/C10H12BrNO2/c1-6(2)14-9-4-3-7(11)5-8(9)10(12)13/h3-6H,1-2H3,(H2,12,13)
InChIKeyFDRBYSYMMZOUQS-UHFFFAOYSA-N
XLogP2.34
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.12
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-bromo-2-propan-2-yloxyphenyl)ethanone
CID 60643994
[4-(5-bromo-2-propan-2-yloxybenzoyl)piperazin-1-yl]-(5-bromo-2-propan-2-yloxyphenyl)methanone
CID 17052202
5-bromo-2-(3-methylbutoxy)benzamide
CID 67555588
phenyl 5-bromo-2-propan-2-yloxybenzoate
CID 23013210
5-bromo-2-(3-methylbutan-2-yloxy)benzenecarbothioamide
CID 114892284
methyl (2S)-2-(2-acetyl-4-bromophenoxy)propanoate
CID 94158655
5-bromo-2-(trifluoromethoxy)benzamide
CID 155804273
4-[(5-bromo-2-propan-2-yloxybenzoyl)amino]benzoic acid
CID 54856038
(2-bromo-4-ethylphenyl) 5-bromo-2-propan-2-yloxybenzoate
CID 23013240
5-bromo-2-(4-bromo-3-methylphenoxy)benzamide
CID 114892345
2-(4-bromo-2-carbamothioylphenoxy)-N,N-diethylpropanamide
CID 83145220
2-[(5-bromo-2-propan-2-yloxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 17051471

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-propan-2-yloxybenzamide?
The IUPAC name of 5-bromo-2-propan-2-yloxybenzamide (CID 17052192) is 5-bromo-2-propan-2-yloxybenzamide.
What is the SMILES notation for 5-bromo-2-propan-2-yloxybenzamide?
The canonical SMILES for 5-bromo-2-propan-2-yloxybenzamide is CC(C)Oc1ccc(Br)cc1C(N)=O.
What is the InChIKey of 5-bromo-2-propan-2-yloxybenzamide?
The InChIKey is FDRBYSYMMZOUQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrNO2/c1-6(2)14-9-4-3-7(11)5-8(9)10(12)13/h3-6H,1-2H3,(H2,12,13).
What are the key properties of 5-bromo-2-propan-2-yloxybenzamide?
5-bromo-2-propan-2-yloxybenzamide has a molecular weight of 258.12 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-propan-2-yloxybenzamide is sourced from PubChem (CID 17052192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).