N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide

C11H12BrClN2O2 — CID 81263696

IUPACN-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Br)C1CNCCO1
InChIInChI=1S/C11H12BrClN2O2/c12-8-5-7(13)1-2-9(8)15-11(16)10-6-14-3-4-17-10/h1-2,5,10,14H,3-4,6H2,(H,15,16)
InChIKeyWLEBIWYCNXRXMB-UHFFFAOYSA-N
MW319.59 g/mol
LogP2.03
Rot. Bonds2

About N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide

N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide (PubChem CID 81263696) has the molecular formula C11H12BrClN2O2 and a molecular weight of 319.59 g/mol. Its IUPAC name is N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide
PubChem CID81263696
Molecular FormulaC11H12BrClN2O2
Molecular Weight319.59 g/mol
Exact Mass317.98
IUPAC NameN-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Br)C1CNCCO1
InChIInChI=1S/C11H12BrClN2O2/c12-8-5-7(13)1-2-9(8)15-11(16)10-6-14-3-4-17-10/h1-2,5,10,14H,3-4,6H2,(H,15,16)
InChIKeyWLEBIWYCNXRXMB-UHFFFAOYSA-N
XLogP2.03
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.59
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide 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-(4-chloro-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119671690
N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide
CID 62816271
N-(2-bromo-4-chlorophenyl)piperidine-3-carboxamide
CID 81263705
N-(5-chloro-2-propoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119725674
N-(2-fluoro-4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119675290
N-(3-chloro-2-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119671790
N-(5-bromo-2-methoxyphenyl)morpholine-2-carboxamide;hydrochloride
CID 119729353
N-(2,4,5-trimethoxyphenyl)morpholine-2-carboxamide
CID 119808138
N-(2-bromo-5-chlorophenyl)oxolane-2-carboxamide
CID 81272173
N-(5-bromo-2-morpholin-4-ylphenyl)morpholine-2-carboxamide
CID 119833788
(2R)-N-(2-bromo-4-chlorophenyl)piperidine-2-carboxamide
CID 104914354
N-(6-bromo-3-pyridinyl)morpholine-2-carboxamide
CID 103813958

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide?
The IUPAC name of N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide (CID 81263696) is N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide.
What is the SMILES notation for N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide?
The canonical SMILES for N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide is O=C(Nc1ccc(Cl)cc1Br)C1CNCCO1.
What is the InChIKey of N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide?
The InChIKey is WLEBIWYCNXRXMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrClN2O2/c12-8-5-7(13)1-2-9(8)15-11(16)10-6-14-3-4-17-10/h1-2,5,10,14H,3-4,6H2,(H,15,16).
What are the key properties of N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide?
N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide has a molecular weight of 319.59 g/mol, XLogP of 2.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-chlorophenyl)morpholine-2-carboxamide is sourced from PubChem (CID 81263696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).