4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine

C10H20N2O — CID 10607561

IUPAC4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine
SMILESCCN1CC[C@H](N2CCOCC2)C1
InChIInChI=1S/C10H20N2O/c1-2-11-4-3-10(9-11)12-5-7-13-8-6-12/h10H,2-9H2,1H3/t10-/m0/s1
InChIKeyBSECBPMHUPMKPQ-JTQLQIEISA-N
MW184.28 g/mol
LogP0.41
Rot. Bonds2

About 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine

4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine (PubChem CID 10607561) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine.

Molecular Properties

Compound Name4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine
PubChem CID10607561
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine
SMILESCCN1CC[C@H](N2CCOCC2)C1
InChIInChI=1S/C10H20N2O/c1-2-11-4-3-10(9-11)12-5-7-13-8-6-12/h10H,2-9H2,1H3/t10-/m0/s1
InChIKeyBSECBPMHUPMKPQ-JTQLQIEISA-N
XLogP0.41
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine?
The IUPAC name of 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine (CID 10607561) is 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine.
What is the SMILES notation for 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine?
The canonical SMILES for 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine is CCN1CC[C@H](N2CCOCC2)C1.
What is the InChIKey of 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine?
The InChIKey is BSECBPMHUPMKPQ-JTQLQIEISA-N. The full InChI is InChI=1S/C10H20N2O/c1-2-11-4-3-10(9-11)12-5-7-13-8-6-12/h10H,2-9H2,1H3/t10-/m0/s1.
What are the key properties of 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine?
4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine has a molecular weight of 184.28 g/mol, XLogP of 0.41, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3S)-1-ethylpyrrolidin-3-yl]morpholine is sourced from PubChem (CID 10607561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).