(3R)-3-ethenyl-4-propylmorpholine

C9H17NO — CID 129222295

IUPAC(3R)-3-ethenyl-4-propylmorpholine
SMILESC=C[C@@H]1COCCN1CCC
InChIInChI=1S/C9H17NO/c1-3-5-10-6-7-11-8-9(10)4-2/h4,9H,2-3,5-8H2,1H3/t9-/m1/s1
InChIKeyGDQTWUQHWRDLQR-SECBINFHSA-N
MW155.24 g/mol
LogP1.28
Rot. Bonds3

About (3R)-3-ethenyl-4-propylmorpholine

(3R)-3-ethenyl-4-propylmorpholine (PubChem CID 129222295) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is (3R)-3-ethenyl-4-propylmorpholine.

Molecular Properties

Compound Name(3R)-3-ethenyl-4-propylmorpholine
PubChem CID129222295
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name(3R)-3-ethenyl-4-propylmorpholine
SMILESC=C[C@@H]1COCCN1CCC
InChIInChI=1S/C9H17NO/c1-3-5-10-6-7-11-8-9(10)4-2/h4,9H,2-3,5-8H2,1H3/t9-/m1/s1
InChIKeyGDQTWUQHWRDLQR-SECBINFHSA-N
XLogP1.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-Methyl-4-(prop-2-en-1-yl)morpholin-4-ium
CID 18617911
N-(3-penten-2-yl)-morpholine
CID 3828336
Morpholine, 4-(1-methyl-2-propenyl)-
CID 12243759
n-Allyl-n-methylmorpholinium bromide
CID 18617910
4-Ethyl-4-prop-2-enylmorpholin-4-ium
CID 68589736
4-Pent-2-enylmorpholine
CID 68590211
Morpholine, 4-(3-butenyl)-
CID 3375564
3-Morpholino-1,7-octadiene
CID 12243761
4-(1-Allyl-3-vinylprop-2-yn-1-yl)morpholine
CID 129745390
4-Allyl-4-ethylmorpholinium chloride
CID 139075365
3-(Morpholinomethoxymethyl)prop-1-ene
CID 177845921
4-Morpholylhepta-2,3-diene
CID 581728

Frequently Asked Questions

What is the IUPAC name of (3R)-3-ethenyl-4-propylmorpholine?
The IUPAC name of (3R)-3-ethenyl-4-propylmorpholine (CID 129222295) is (3R)-3-ethenyl-4-propylmorpholine.
What is the SMILES notation for (3R)-3-ethenyl-4-propylmorpholine?
The canonical SMILES for (3R)-3-ethenyl-4-propylmorpholine is C=C[C@@H]1COCCN1CCC.
What is the InChIKey of (3R)-3-ethenyl-4-propylmorpholine?
The InChIKey is GDQTWUQHWRDLQR-SECBINFHSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-5-10-6-7-11-8-9(10)4-2/h4,9H,2-3,5-8H2,1H3/t9-/m1/s1.
What are the key properties of (3R)-3-ethenyl-4-propylmorpholine?
(3R)-3-ethenyl-4-propylmorpholine has a molecular weight of 155.24 g/mol, XLogP of 1.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-ethenyl-4-propylmorpholine is sourced from PubChem (CID 129222295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).