3-bromo-5-chloro-N-cyclopropylbenzamide

C10H9BrClNO — CID 110406468

IUPAC3-bromo-5-chloro-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C10H9BrClNO/c11-7-3-6(4-8(12)5-7)10(14)13-9-1-2-9/h3-5,9H,1-2H2,(H,13,14)
InChIKeyARLNMTYTDIFAGA-UHFFFAOYSA-N
MW274.55 g/mol
LogP2.99
Rot. Bonds2

About 3-bromo-5-chloro-N-cyclopropylbenzamide

3-bromo-5-chloro-N-cyclopropylbenzamide (PubChem CID 110406468) has the molecular formula C10H9BrClNO and a molecular weight of 274.55 g/mol. Its IUPAC name is 3-bromo-5-chloro-N-cyclopropylbenzamide.

Molecular Properties

Compound Name3-bromo-5-chloro-N-cyclopropylbenzamide
PubChem CID110406468
Molecular FormulaC10H9BrClNO
Molecular Weight274.55 g/mol
Exact Mass272.96
IUPAC Name3-bromo-5-chloro-N-cyclopropylbenzamide
SMILESO=C(NC1CC1)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C10H9BrClNO/c11-7-3-6(4-8(12)5-7)10(14)13-9-1-2-9/h3-5,9H,1-2H2,(H,13,14)
InChIKeyARLNMTYTDIFAGA-UHFFFAOYSA-N
XLogP2.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.55
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 110411834
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2-[(3-bromo-5-chlorobenzoyl)amino]cycloheptane-1-carboxylic acid
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3,5-dibromo-N-[4-(trifluoromethyl)cyclohexyl]benzamide
CID 107980263
3-bromo-N-cyclopropyl-5-nitrobenzamide
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3-bromo-5-chloro-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylbenzamide
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3-amino-5-bromo-N-cyclopentylbenzamide
CID 75537164
3-chloro-N-cyclopentyl-5-methylbenzamide
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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-N-cyclopropylbenzamide?
The IUPAC name of 3-bromo-5-chloro-N-cyclopropylbenzamide (CID 110406468) is 3-bromo-5-chloro-N-cyclopropylbenzamide.
What is the SMILES notation for 3-bromo-5-chloro-N-cyclopropylbenzamide?
The canonical SMILES for 3-bromo-5-chloro-N-cyclopropylbenzamide is O=C(NC1CC1)c1cc(Cl)cc(Br)c1.
What is the InChIKey of 3-bromo-5-chloro-N-cyclopropylbenzamide?
The InChIKey is ARLNMTYTDIFAGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClNO/c11-7-3-6(4-8(12)5-7)10(14)13-9-1-2-9/h3-5,9H,1-2H2,(H,13,14).
What are the key properties of 3-bromo-5-chloro-N-cyclopropylbenzamide?
3-bromo-5-chloro-N-cyclopropylbenzamide has a molecular weight of 274.55 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-N-cyclopropylbenzamide is sourced from PubChem (CID 110406468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).