2-propan-2-ylmorpholine

C7H15NO — CID 19877688

IUPAC2-propan-2-ylmorpholine
SMILESCC(C)C1CNCCO1
InChIInChI=1S/C7H15NO/c1-6(2)7-5-8-3-4-9-7/h6-8H,3-5H2,1-2H3
InChIKeyDNBOOEPFXFVICE-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.63
Rot. Bonds1

About 2-propan-2-ylmorpholine

2-propan-2-ylmorpholine (PubChem CID 19877688) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is 2-propan-2-ylmorpholine.

Molecular Properties

Compound Name2-propan-2-ylmorpholine
PubChem CID19877688
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC Name2-propan-2-ylmorpholine
SMILESCC(C)C1CNCCO1
InChIInChI=1S/C7H15NO/c1-6(2)7-5-8-3-4-9-7/h6-8H,3-5H2,1-2H3
InChIKeyDNBOOEPFXFVICE-UHFFFAOYSA-N
XLogP0.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-ylmorpholine?
The IUPAC name of 2-propan-2-ylmorpholine (CID 19877688) is 2-propan-2-ylmorpholine.
What is the SMILES notation for 2-propan-2-ylmorpholine?
The canonical SMILES for 2-propan-2-ylmorpholine is CC(C)C1CNCCO1.
What is the InChIKey of 2-propan-2-ylmorpholine?
The InChIKey is DNBOOEPFXFVICE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-6(2)7-5-8-3-4-9-7/h6-8H,3-5H2,1-2H3.
What are the key properties of 2-propan-2-ylmorpholine?
2-propan-2-ylmorpholine has a molecular weight of 129.20 g/mol, XLogP of 0.63, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-ylmorpholine is sourced from PubChem (CID 19877688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).