4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine

C10H20N2O — CID 99868070

IUPAC4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine
SMILESCC1(C)NCC[C@H]1N1CCOCC1
InChIInChI=1S/C10H20N2O/c1-10(2)9(3-4-11-10)12-5-7-13-8-6-12/h9,11H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyLEESGEVWDFMPMM-SECBINFHSA-N
MW184.28 g/mol
LogP0.46
Rot. Bonds1

About 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine

4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine (PubChem CID 99868070) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine.

Molecular Properties

Compound Name4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine
PubChem CID99868070
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine
SMILESCC1(C)NCC[C@H]1N1CCOCC1
InChIInChI=1S/C10H20N2O/c1-10(2)9(3-4-11-10)12-5-7-13-8-6-12/h9,11H,3-8H2,1-2H3/t9-/m1/s1
InChIKeyLEESGEVWDFMPMM-SECBINFHSA-N
XLogP0.46
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine?
The IUPAC name of 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine (CID 99868070) is 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine.
What is the SMILES notation for 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine?
The canonical SMILES for 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine is CC1(C)NCC[C@H]1N1CCOCC1.
What is the InChIKey of 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine?
The InChIKey is LEESGEVWDFMPMM-SECBINFHSA-N. The full InChI is InChI=1S/C10H20N2O/c1-10(2)9(3-4-11-10)12-5-7-13-8-6-12/h9,11H,3-8H2,1-2H3/t9-/m1/s1.
What are the key properties of 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine?
4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine has a molecular weight of 184.28 g/mol, XLogP of 0.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-2,2-dimethylpyrrolidin-3-yl]morpholine is sourced from PubChem (CID 99868070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).