3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide

C15H15BrClNO — CID 114096125

IUPAC3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
SMILESO=C(NC1C2C3CCC(C3)C12)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C15H15BrClNO/c16-10-4-9(5-11(17)6-10)15(19)18-14-12-7-1-2-8(3-7)13(12)14/h4-8,12-14H,1-3H2,(H,18,19)
InChIKeyFKUPCVYQCLUIHF-UHFFFAOYSA-N
MW340.65 g/mol
LogP3.88
Rot. Bonds2

About 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide

3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide (PubChem CID 114096125) has the molecular formula C15H15BrClNO and a molecular weight of 340.65 g/mol. Its IUPAC name is 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide.

Molecular Properties

Compound Name3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
PubChem CID114096125
Molecular FormulaC15H15BrClNO
Molecular Weight340.65 g/mol
Exact Mass339.00
IUPAC Name3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
SMILESO=C(NC1C2C3CCC(C3)C12)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C15H15BrClNO/c16-10-4-9(5-11(17)6-10)15(19)18-14-12-7-1-2-8(3-7)13(12)14/h4-8,12-14H,1-3H2,(H,18,19)
InChIKeyFKUPCVYQCLUIHF-UHFFFAOYSA-N
XLogP3.88
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.65
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-bromo-5-chloro-N-cyclopropylbenzamide
CID 110406468
2-[(3-bromo-5-chlorobenzoyl)amino]cycloheptane-1-carboxylic acid
CID 107938194
3-chloro-4-hydroxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
CID 103767220
3-bromo-5-chloro-N-(1,1-dioxothiolan-3-yl)benzamide
CID 110411834
3-bromo-5-chloro-N-(1-methylsulfonylpiperidin-4-yl)benzamide
CID 103826480
3-bromo-5-chloro-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 107939665
4-bromo-3-methyl-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
CID 103855353
5-bromo-2-fluoro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
CID 103767098
3-bromo-5-chlorobenzoyl chloride
CID 50998129
1,2-bis(3-bromo-5-chlorophenyl)ethane-1,2-dione
CID 139745262
3-bromo-5-chloro-N-(2,6-dimethylpiperidin-1-yl)benzamide
CID 107953127
3,5-dibromo-N-(2-cyclopropyloxolan-3-yl)benzamide
CID 103908532

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide?
The IUPAC name of 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide (CID 114096125) is 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide.
What is the SMILES notation for 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide?
The canonical SMILES for 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide is O=C(NC1C2C3CCC(C3)C12)c1cc(Cl)cc(Br)c1.
What is the InChIKey of 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide?
The InChIKey is FKUPCVYQCLUIHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClNO/c16-10-4-9(5-11(17)6-10)15(19)18-14-12-7-1-2-8(3-7)13(12)14/h4-8,12-14H,1-3H2,(H,18,19).
What are the key properties of 3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide?
3-bromo-5-chloro-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide has a molecular weight of 340.65 g/mol, XLogP of 3.88, 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-(3-tricyclo[3.2.1.02,4]octanyl)benzamide is sourced from PubChem (CID 114096125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).