2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine

C10H12BrClN2O — CID 81210670

IUPAC2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine
SMILESClc1ccc(N2CCOC(CBr)C2)nc1
InChIInChI=1S/C10H12BrClN2O/c11-5-9-7-14(3-4-15-9)10-2-1-8(12)6-13-10/h1-2,6,9H,3-5,7H2
InChIKeyBWFWAWBXUXGBRH-UHFFFAOYSA-N
MW291.58 g/mol
LogP2.34
Rot. Bonds2

About 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine

2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine (PubChem CID 81210670) has the molecular formula C10H12BrClN2O and a molecular weight of 291.58 g/mol. Its IUPAC name is 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine.

Molecular Properties

Compound Name2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine
PubChem CID81210670
Molecular FormulaC10H12BrClN2O
Molecular Weight291.58 g/mol
Exact Mass289.98
IUPAC Name2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine
SMILESClc1ccc(N2CCOC(CBr)C2)nc1
InChIInChI=1S/C10H12BrClN2O/c11-5-9-7-14(3-4-15-9)10-2-1-8(12)6-13-10/h1-2,6,9H,3-5,7H2
InChIKeyBWFWAWBXUXGBRH-UHFFFAOYSA-N
XLogP2.34
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.58
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-(bromomethyl)-4-(5-fluoro-2-pyridinyl)morpholine
CID 81210294
2-(bromomethyl)-4-(3,5-dichloro-2-pyridinyl)morpholine
CID 81210900
1-[4-(5-chloro-2-pyridinyl)morpholin-2-yl]ethanamine
CID 115315765
2-(bromomethyl)-4-(4-methyl-2-pyridinyl)morpholine
CID 81211013
4-(5-bromo-2-pyridinyl)-2-(methoxymethyl)morpholine
CID 71996193
[4-(5-methoxy-2-pyridinyl)morpholin-2-yl]methanol
CID 106504669
2-[3-(2-bromoethyl)piperidin-1-yl]-5-chloropyridine
CID 80679523
[6-(2-ethylmorpholin-4-yl)-3-pyridinyl]methanamine
CID 43562218
4-(5-chloro-2-pyridinyl)-1,4-oxazepane
CID 66234346
5-chloro-2-(3,4-dimethylpiperidin-1-yl)pyridine
CID 115871255
2-(bromomethyl)-4-(5-chloro-2-methoxypyrimidin-4-yl)morpholine
CID 81210414
2-[4-(5-methyl-2-pyridinyl)morpholin-2-yl]acetic acid
CID 66433835

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine?
The IUPAC name of 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine (CID 81210670) is 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine.
What is the SMILES notation for 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine?
The canonical SMILES for 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine is Clc1ccc(N2CCOC(CBr)C2)nc1.
What is the InChIKey of 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine?
The InChIKey is BWFWAWBXUXGBRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12BrClN2O/c11-5-9-7-14(3-4-15-9)10-2-1-8(12)6-13-10/h1-2,6,9H,3-5,7H2.
What are the key properties of 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine?
2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine has a molecular weight of 291.58 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)-4-(5-chloro-2-pyridinyl)morpholine is sourced from PubChem (CID 81210670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).