6-methyl-4-propan-2-ylmorpholin-3-one

C8H15NO2 — CID 14382399

IUPAC6-methyl-4-propan-2-ylmorpholin-3-one
SMILESCC1CN(C(C)C)C(=O)CO1
InChIInChI=1S/C8H15NO2/c1-6(2)9-4-7(3)11-5-8(9)10/h6-7H,4-5H2,1-3H3
InChIKeyWWICKIPMDQBQGQ-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.64
Rot. Bonds1

About 6-methyl-4-propan-2-ylmorpholin-3-one

6-methyl-4-propan-2-ylmorpholin-3-one (PubChem CID 14382399) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 6-methyl-4-propan-2-ylmorpholin-3-one.

Molecular Properties

Compound Name6-methyl-4-propan-2-ylmorpholin-3-one
PubChem CID14382399
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name6-methyl-4-propan-2-ylmorpholin-3-one
SMILESCC1CN(C(C)C)C(=O)CO1
InChIInChI=1S/C8H15NO2/c1-6(2)9-4-7(3)11-5-8(9)10/h6-7H,4-5H2,1-3H3
InChIKeyWWICKIPMDQBQGQ-UHFFFAOYSA-N
XLogP0.64
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-propan-2-ylmorpholin-3-one?
The IUPAC name of 6-methyl-4-propan-2-ylmorpholin-3-one (CID 14382399) is 6-methyl-4-propan-2-ylmorpholin-3-one.
What is the SMILES notation for 6-methyl-4-propan-2-ylmorpholin-3-one?
The canonical SMILES for 6-methyl-4-propan-2-ylmorpholin-3-one is CC1CN(C(C)C)C(=O)CO1.
What is the InChIKey of 6-methyl-4-propan-2-ylmorpholin-3-one?
The InChIKey is WWICKIPMDQBQGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-6(2)9-4-7(3)11-5-8(9)10/h6-7H,4-5H2,1-3H3.
What are the key properties of 6-methyl-4-propan-2-ylmorpholin-3-one?
6-methyl-4-propan-2-ylmorpholin-3-one has a molecular weight of 157.21 g/mol, XLogP of 0.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-propan-2-ylmorpholin-3-one is sourced from PubChem (CID 14382399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).