4-(9-bromononyl)-3-ethylmorpholine

C15H30BrNO — CID 105343626

IUPAC4-(9-bromononyl)-3-ethylmorpholine
SMILESCCC1COCCN1CCCCCCCCCBr
InChIInChI=1S/C15H30BrNO/c1-2-15-14-18-13-12-17(15)11-9-7-5-3-4-6-8-10-16/h15H,2-14H2,1H3
InChIKeyKMUAMDNDQIWABX-UHFFFAOYSA-N
MW320.32 g/mol
LogP4.22
Rot. Bonds10

About 4-(9-bromononyl)-3-ethylmorpholine

4-(9-bromononyl)-3-ethylmorpholine (PubChem CID 105343626) has the molecular formula C15H30BrNO and a molecular weight of 320.32 g/mol. Its IUPAC name is 4-(9-bromononyl)-3-ethylmorpholine.

Molecular Properties

Compound Name4-(9-bromononyl)-3-ethylmorpholine
PubChem CID105343626
Molecular FormulaC15H30BrNO
Molecular Weight320.32 g/mol
Exact Mass319.15
IUPAC Name4-(9-bromononyl)-3-ethylmorpholine
SMILESCCC1COCCN1CCCCCCCCCBr
InChIInChI=1S/C15H30BrNO/c1-2-15-14-18-13-12-17(15)11-9-7-5-3-4-6-8-10-16/h15H,2-14H2,1H3
InChIKeyKMUAMDNDQIWABX-UHFFFAOYSA-N
XLogP4.22
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.32
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(3-bromopropyl)-3-ethylmorpholine
CID 61288372
4-(3-chloropropyl)-3-ethylmorpholine
CID 61288570
6-(3-ethylmorpholin-4-yl)hexan-3-one
CID 106801201
N-[4-(3-ethylmorpholin-4-yl)butyl]cyclopropanamine
CID 62432568
3,4-di(tridecyl)morpholine
CID 172742724
1-(4-bromophenyl)-4-(3-ethylmorpholin-4-yl)butan-1-one
CID 43793216
N-[3-(3-ethylmorpholin-4-yl)propyl]cyclopropanamine
CID 60867675
3-ethyl-4-(2-methoxyethyl)morpholine
CID 157403746
3-ethyl-4-hexadecylmorpholine;ethyl hydrogen sulfate
CID 158591887
5-bromo-1-(3-ethylmorpholin-4-yl)pentan-1-one
CID 107908453
N-methyl-1-(4-octylmorpholin-3-yl)methanamine
CID 83099737
4-(3-bromo-2-methylpropyl)-3-ethylmorpholine
CID 64996341

Frequently Asked Questions

What is the IUPAC name of 4-(9-bromononyl)-3-ethylmorpholine?
The IUPAC name of 4-(9-bromononyl)-3-ethylmorpholine (CID 105343626) is 4-(9-bromononyl)-3-ethylmorpholine.
What is the SMILES notation for 4-(9-bromononyl)-3-ethylmorpholine?
The canonical SMILES for 4-(9-bromononyl)-3-ethylmorpholine is CCC1COCCN1CCCCCCCCCBr.
What is the InChIKey of 4-(9-bromononyl)-3-ethylmorpholine?
The InChIKey is KMUAMDNDQIWABX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30BrNO/c1-2-15-14-18-13-12-17(15)11-9-7-5-3-4-6-8-10-16/h15H,2-14H2,1H3.
What are the key properties of 4-(9-bromononyl)-3-ethylmorpholine?
4-(9-bromononyl)-3-ethylmorpholine has a molecular weight of 320.32 g/mol, XLogP of 4.22, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9-bromononyl)-3-ethylmorpholine is sourced from PubChem (CID 105343626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).