4-(2-bromoprop-2-enyl)-3-ethylmorpholine

C9H16BrNO — CID 130927364

IUPAC4-(2-bromoprop-2-enyl)-3-ethylmorpholine
SMILESC=C(Br)CN1CCOCC1CC
InChIInChI=1S/C9H16BrNO/c1-3-9-7-12-5-4-11(9)6-8(2)10/h9H,2-7H2,1H3
InChIKeyWYVIUDUFWCXWHZ-UHFFFAOYSA-N
MW234.14 g/mol
LogP2.01
Rot. Bonds3

About 4-(2-bromoprop-2-enyl)-3-ethylmorpholine

4-(2-bromoprop-2-enyl)-3-ethylmorpholine (PubChem CID 130927364) has the molecular formula C9H16BrNO and a molecular weight of 234.14 g/mol. Its IUPAC name is 4-(2-bromoprop-2-enyl)-3-ethylmorpholine.

Molecular Properties

Compound Name4-(2-bromoprop-2-enyl)-3-ethylmorpholine
PubChem CID130927364
Molecular FormulaC9H16BrNO
Molecular Weight234.14 g/mol
Exact Mass233.04
IUPAC Name4-(2-bromoprop-2-enyl)-3-ethylmorpholine
SMILESC=C(Br)CN1CCOCC1CC
InChIInChI=1S/C9H16BrNO/c1-3-9-7-12-5-4-11(9)6-8(2)10/h9H,2-7H2,1H3
InChIKeyWYVIUDUFWCXWHZ-UHFFFAOYSA-N
XLogP2.01
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.14
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-bromoprop-2-enyl)-3-cyclopropylmorpholine
CID 130660267
4-(3-bromopropyl)-3-ethylmorpholine
CID 61288372
4-(3-ethylmorpholin-4-yl)-3-methylbut-2-enoic acid
CID 77006511
4-(2-bromoprop-2-enyl)-3-methyl-1,4-oxazepane
CID 130739918
4-(3-bromo-2-methylpropyl)-3-ethylmorpholine
CID 64996341
4-(9-bromononyl)-3-ethylmorpholine
CID 105343626
2-[(3R)-4-(2-bromoprop-2-enyl)morpholin-3-yl]-1-(furan-2-yl)ethanone
CID 99586170
2-(3-ethylmorpholin-4-yl)-1-(4-hydroxyphenyl)ethanone
CID 43797584
4-(3-chloropropyl)-3-ethylmorpholine
CID 61288570
3-ethyl-4-(2-methoxyethyl)morpholine
CID 157403746
3-ethyl-4-[(1-fluorocyclopropyl)methyl]morpholine
CID 131155594
1-(5-bromothiophen-2-yl)-2-(3-ethylmorpholin-4-yl)ethanone
CID 43797577

Frequently Asked Questions

What is the IUPAC name of 4-(2-bromoprop-2-enyl)-3-ethylmorpholine?
The IUPAC name of 4-(2-bromoprop-2-enyl)-3-ethylmorpholine (CID 130927364) is 4-(2-bromoprop-2-enyl)-3-ethylmorpholine.
What is the SMILES notation for 4-(2-bromoprop-2-enyl)-3-ethylmorpholine?
The canonical SMILES for 4-(2-bromoprop-2-enyl)-3-ethylmorpholine is C=C(Br)CN1CCOCC1CC.
What is the InChIKey of 4-(2-bromoprop-2-enyl)-3-ethylmorpholine?
The InChIKey is WYVIUDUFWCXWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16BrNO/c1-3-9-7-12-5-4-11(9)6-8(2)10/h9H,2-7H2,1H3.
What are the key properties of 4-(2-bromoprop-2-enyl)-3-ethylmorpholine?
4-(2-bromoprop-2-enyl)-3-ethylmorpholine has a molecular weight of 234.14 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-bromoprop-2-enyl)-3-ethylmorpholine is sourced from PubChem (CID 130927364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).