5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide

C15H20BrClN2O — CID 110413932

IUPAC5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide
SMILESCC(C)(CNC(=O)c1cc(Br)ccc1Cl)N1CCCC1
InChIInChI=1S/C15H20BrClN2O/c1-15(2,19-7-3-4-8-19)10-18-14(20)12-9-11(16)5-6-13(12)17/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,18,20)
InChIKeyLEKZJSNLVDWWPR-UHFFFAOYSA-N
MW359.70 g/mol
LogP3.71
Rot. Bonds4

About 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide

5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide (PubChem CID 110413932) has the molecular formula C15H20BrClN2O and a molecular weight of 359.70 g/mol. Its IUPAC name is 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide
PubChem CID110413932
Molecular FormulaC15H20BrClN2O
Molecular Weight359.70 g/mol
Exact Mass358.04
IUPAC Name5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide
SMILESCC(C)(CNC(=O)c1cc(Br)ccc1Cl)N1CCCC1
InChIInChI=1S/C15H20BrClN2O/c1-15(2,19-7-3-4-8-19)10-18-14(20)12-9-11(16)5-6-13(12)17/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,18,20)
InChIKeyLEKZJSNLVDWWPR-UHFFFAOYSA-N
XLogP3.71
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.70
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)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

N-(2-amino-2-methylpropyl)-5-bromo-2-chlorobenzamide;hydrochloride
CID 119629541
5-bromo-2-chloro-N-(3-chloro-2,2-dimethylpropyl)benzamide
CID 115364457
2,5-dibromo-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide
CID 114371891
5-bromo-2-chloro-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzamide
CID 112683751
2-bromo-N-(2-methyl-2-piperidin-1-ylpropyl)benzamide
CID 51148947
5-bromo-2-chloro-N-(2-cyclopropyl-2-hydroxypropyl)benzamide
CID 90499338
5-bromo-2-chloro-N-(2-ethyl-2-methylsulfanylbutyl)benzamide
CID 103709313
N-(2-amino-2-ethylbutyl)-5-bromo-2-chlorobenzamide;hydrochloride
CID 119642954
6-chloro-2-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)quinoline-3-carboxamide
CID 55522789
2-chloro-7-fluoro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)quinoline-3-carboxamide
CID 110303168
5-bromo-N-(1-tert-butylpiperidin-4-yl)-2-chlorobenzamide
CID 61034621
2-(3,4-dichlorophenyl)-3-methyl-N-(2-methyl-2-pyrrolidin-1-ylpropyl)butanamide
CID 110303185

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide?
The IUPAC name of 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide (CID 110413932) is 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide.
What is the SMILES notation for 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide?
The canonical SMILES for 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide is CC(C)(CNC(=O)c1cc(Br)ccc1Cl)N1CCCC1.
What is the InChIKey of 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide?
The InChIKey is LEKZJSNLVDWWPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrClN2O/c1-15(2,19-7-3-4-8-19)10-18-14(20)12-9-11(16)5-6-13(12)17/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,18,20).
What are the key properties of 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide?
5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide has a molecular weight of 359.70 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-chloro-N-(2-methyl-2-pyrrolidin-1-ylpropyl)benzamide is sourced from PubChem (CID 110413932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).