4,6-dimethyl-2-nitrosomorpholin-3-one

C6H10N2O3 — CID 54568604

IUPAC4,6-dimethyl-2-nitrosomorpholin-3-one
SMILESCC1CN(C)C(=O)C(N=O)O1
InChIInChI=1S/C6H10N2O3/c1-4-3-8(2)6(9)5(7-10)11-4/h4-5H,3H2,1-2H3
InChIKeyZVPRCRHFAGENCF-UHFFFAOYSA-N
MW158.16 g/mol
LogP-0.04
Rot. Bonds1

About 4,6-dimethyl-2-nitrosomorpholin-3-one

4,6-dimethyl-2-nitrosomorpholin-3-one (PubChem CID 54568604) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is 4,6-dimethyl-2-nitrosomorpholin-3-one.

Molecular Properties

Compound Name4,6-dimethyl-2-nitrosomorpholin-3-one
PubChem CID54568604
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Name4,6-dimethyl-2-nitrosomorpholin-3-one
SMILESCC1CN(C)C(=O)C(N=O)O1
InChIInChI=1S/C6H10N2O3/c1-4-3-8(2)6(9)5(7-10)11-4/h4-5H,3H2,1-2H3
InChIKeyZVPRCRHFAGENCF-UHFFFAOYSA-N
XLogP-0.04
TPSA58.97 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-0.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-nitrosomorpholin-3-one?
The IUPAC name of 4,6-dimethyl-2-nitrosomorpholin-3-one (CID 54568604) is 4,6-dimethyl-2-nitrosomorpholin-3-one.
What is the SMILES notation for 4,6-dimethyl-2-nitrosomorpholin-3-one?
The canonical SMILES for 4,6-dimethyl-2-nitrosomorpholin-3-one is CC1CN(C)C(=O)C(N=O)O1.
What is the InChIKey of 4,6-dimethyl-2-nitrosomorpholin-3-one?
The InChIKey is ZVPRCRHFAGENCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c1-4-3-8(2)6(9)5(7-10)11-4/h4-5H,3H2,1-2H3.
What are the key properties of 4,6-dimethyl-2-nitrosomorpholin-3-one?
4,6-dimethyl-2-nitrosomorpholin-3-one has a molecular weight of 158.16 g/mol, XLogP of -0.04, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-nitrosomorpholin-3-one is sourced from PubChem (CID 54568604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).