2-(2-bromophenyl)-4-propylmorpholine

C13H18BrNO — CID 82184644

IUPAC2-(2-bromophenyl)-4-propylmorpholine
SMILESCCCN1CCOC(c2ccccc2Br)C1
InChIInChI=1S/C13H18BrNO/c1-2-7-15-8-9-16-13(10-15)11-5-3-4-6-12(11)14/h3-6,13H,2,7-10H2,1H3
InChIKeyDFSLYTISZKOPFY-UHFFFAOYSA-N
MW284.20 g/mol
LogP3.23
Rot. Bonds3

About 2-(2-bromophenyl)-4-propylmorpholine

2-(2-bromophenyl)-4-propylmorpholine (PubChem CID 82184644) has the molecular formula C13H18BrNO and a molecular weight of 284.20 g/mol. Its IUPAC name is 2-(2-bromophenyl)-4-propylmorpholine.

Molecular Properties

Compound Name2-(2-bromophenyl)-4-propylmorpholine
PubChem CID82184644
Molecular FormulaC13H18BrNO
Molecular Weight284.20 g/mol
Exact Mass283.06
IUPAC Name2-(2-bromophenyl)-4-propylmorpholine
SMILESCCCN1CCOC(c2ccccc2Br)C1
InChIInChI=1S/C13H18BrNO/c1-2-7-15-8-9-16-13(10-15)11-5-3-4-6-12(11)14/h3-6,13H,2,7-10H2,1H3
InChIKeyDFSLYTISZKOPFY-UHFFFAOYSA-N
XLogP3.23
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.20
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2S)-2-(2-bromophenyl)morpholin-4-yl]-N,N-diethylacetamide
CID 95694316
methyl 5-[2-(2-bromophenyl)morpholin-4-yl]pentanoate
CID 91653639
(2S)-2-[(2R)-2-(2-bromophenyl)morpholin-4-yl]butanoic acid
CID 99833548
2-(2-bromophenyl)-4-(6-methylpyrazin-2-yl)morpholine
CID 133469570
(2S)-2-[(2S)-2-(2-bromophenyl)morpholin-4-yl]propanoic acid
CID 124692219
2-[2-(2-fluorophenyl)morpholin-4-yl]ethanamine
CID 82024344
2-(2-bromophenyl)-4-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]morpholine
CID 86879238
3-[2-(2-methylphenyl)morpholin-4-yl]propan-1-ol
CID 111462348
5-bromo-2-(4-propylmorpholin-2-yl)pyrimidin-4-amine
CID 79657263
(2S)-2-amino-1-[(2S)-2-(2-bromophenyl)morpholin-4-yl]propan-1-one
CID 124591971
(2R)-2-[(2R)-2-(2-bromophenyl)morpholin-4-yl]propanamide
CID 94823361
3-[2-(2-chlorophenyl)morpholin-4-yl]propan-1-ol
CID 110936045

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-4-propylmorpholine?
The IUPAC name of 2-(2-bromophenyl)-4-propylmorpholine (CID 82184644) is 2-(2-bromophenyl)-4-propylmorpholine.
What is the SMILES notation for 2-(2-bromophenyl)-4-propylmorpholine?
The canonical SMILES for 2-(2-bromophenyl)-4-propylmorpholine is CCCN1CCOC(c2ccccc2Br)C1.
What is the InChIKey of 2-(2-bromophenyl)-4-propylmorpholine?
The InChIKey is DFSLYTISZKOPFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18BrNO/c1-2-7-15-8-9-16-13(10-15)11-5-3-4-6-12(11)14/h3-6,13H,2,7-10H2,1H3.
What are the key properties of 2-(2-bromophenyl)-4-propylmorpholine?
2-(2-bromophenyl)-4-propylmorpholine has a molecular weight of 284.20 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-4-propylmorpholine is sourced from PubChem (CID 82184644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).