2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine

C11H33NO3 — CID 157422270

IUPAC2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine
SMILESC.C.CC(C)ON.CCOC(C)C.CO
InChIInChI=1S/C5H12O.C3H9NO.CH4O.2CH4/c1-4-6-5(2)3;1-3(2)5-4;1-2;;/h5H,4H2,1-3H3;3H,4H2,1-2H3;2H,1H3;2*1H4
InChIKeyBPNXQYQQHLKTFE-UHFFFAOYSA-N
MW227.39 g/mol
LogP2.60
Rot. Bonds3

About 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine

2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine (PubChem CID 157422270) has the molecular formula C11H33NO3 and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine.

Molecular Properties

Compound Name2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine
PubChem CID157422270
Molecular FormulaC11H33NO3
Molecular Weight227.39 g/mol
Exact Mass227.25
IUPAC Name2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine
SMILESC.C.CC(C)ON.CCOC(C)C.CO
InChIInChI=1S/C5H12O.C3H9NO.CH4O.2CH4/c1-4-6-5(2)3;1-3(2)5-4;1-2;;/h5H,4H2,1-3H3;3H,4H2,1-2H3;2H,1H3;2*1H4
InChIKeyBPNXQYQQHLKTFE-UHFFFAOYSA-N
XLogP2.60
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-ethoxypropane;zinc
CID 174321747
benzene;ethane;2-ethoxypropane
CID 145144041
ethyl 2-propan-2-yloxyacetate
CID 537908
amino 2-ethoxypropanoate
CID 87914402
O-ethylhydroxylamine;propan-2-ol
CID 174873596
ethanamine;1-ethoxyethanol
CID 20501270
3-ethoxy-1-propan-2-yloxybutan-2-ol
CID 79567454
2-ethoxy-3-propan-2-yloxypropan-1-amine
CID 63069873
ethyl 4-propan-2-yloxybutanoate
CID 59323565
1,1-diethoxyethane
CID 7765
propan-2-yloxymethylphosphonamidous acid
CID 87529932
CID 159597367
CID 159597367

Frequently Asked Questions

What is the IUPAC name of 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine?
The IUPAC name of 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine (CID 157422270) is 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine.
What is the SMILES notation for 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine?
The canonical SMILES for 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine is C.C.CC(C)ON.CCOC(C)C.CO.
What is the InChIKey of 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine?
The InChIKey is BPNXQYQQHLKTFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O.C3H9NO.CH4O.2CH4/c1-4-6-5(2)3;1-3(2)5-4;1-2;;/h5H,4H2,1-3H3;3H,4H2,1-2H3;2H,1H3;2*1H4.
What are the key properties of 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine?
2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine has a molecular weight of 227.39 g/mol, XLogP of 2.60, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxypropane;methane;methanol;O-propan-2-ylhydroxylamine is sourced from PubChem (CID 157422270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).