2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone

C10H19NO3 — CID 12636377

IUPAC2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone
SMILESCC(C)(C)OCC(=O)N1CCOCC1
InChIInChI=1S/C10H19NO3/c1-10(2,3)14-8-9(12)11-4-6-13-7-5-11/h4-8H2,1-3H3
InChIKeyIEWLSECOMSFCRF-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.66
Rot. Bonds2

About 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone

2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone (PubChem CID 12636377) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone
PubChem CID12636377
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone
SMILESCC(C)(C)OCC(=O)N1CCOCC1
InChIInChI=1S/C10H19NO3/c1-10(2,3)14-8-9(12)11-4-6-13-7-5-11/h4-8H2,1-3H3
InChIKeyIEWLSECOMSFCRF-UHFFFAOYSA-N
XLogP0.66
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

CID 11007867
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CID 205041
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CID 532078
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CID 204975
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CID 15000282
CID 15000282
CID 2947957
CID 2947957
CID 12766108
CID 12766108
CID 13156567
CID 13156567
CID 15506865
CID 15506865
CID 48690710
CID 48690710
CID 95341089
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CID 129608651
CID 129608651

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone (CID 12636377) is 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone is CC(C)(C)OCC(=O)N1CCOCC1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone?
The InChIKey is IEWLSECOMSFCRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-10(2,3)14-8-9(12)11-4-6-13-7-5-11/h4-8H2,1-3H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone?
2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone has a molecular weight of 201.27 g/mol, XLogP of 0.66, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-1-morpholin-4-ylethanone is sourced from PubChem (CID 12636377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).