1-methoxy-2-methylpropane;3-methyloxolane

C10H22O2 — CID 159278153

IUPAC1-methoxy-2-methylpropane;3-methyloxolane
SMILESCC1CCOC1.COCC(C)C
InChIInChI=1S/C5H10O.C5H12O/c1-5-2-3-6-4-5;1-5(2)4-6-3/h5H,2-4H2,1H3;5H,4H2,1-3H3
InChIKeyKYOOJLCBSULXMW-UHFFFAOYSA-N
MW174.28 g/mol
LogP2.33
Rot. Bonds2

About 1-methoxy-2-methylpropane;3-methyloxolane

1-methoxy-2-methylpropane;3-methyloxolane (PubChem CID 159278153) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is 1-methoxy-2-methylpropane;3-methyloxolane.

Molecular Properties

Compound Name1-methoxy-2-methylpropane;3-methyloxolane
PubChem CID159278153
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Name1-methoxy-2-methylpropane;3-methyloxolane
SMILESCC1CCOC1.COCC(C)C
InChIInChI=1S/C5H10O.C5H12O/c1-5-2-3-6-4-5;1-5(2)4-6-3/h5H,2-4H2,1H3;5H,4H2,1-3H3
InChIKeyKYOOJLCBSULXMW-UHFFFAOYSA-N
XLogP2.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.28
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-methyloxolane
CID 7857636
3-methyloxolane;silyloxysilane
CID 173163882
ethane;4-methyloxane;3-methyloxolane
CID 170734292
methane;methylcyclobutane;3-methyloxolane
CID 160852925
3-methyloxane;3-methyloxetane;3-methyloxolane
CID 159375413
ethane;3-(methoxymethyl)oxolane
CID 143285946
N-[1-(2-methylpropoxy)propan-2-yl]oxolan-3-amine
CID 115689093
1-methoxy-N-(oxan-4-ylmethyl)propan-2-amine
CID 62386572
N-ethyl-2-[2-(2-methylpropoxy)ethoxy]-1-(oxolan-3-yl)ethanamine
CID 106447324
N'-(1-methoxypropan-2-yl)-N'-methyl-1-(oxolan-3-yl)ethane-1,2-diamine
CID 104745360
1-methoxy-3-[2-(oxolan-3-yl)ethylamino]propan-2-ol
CID 102672307
N-methyl-1-(oxolan-3-yloxy)propan-2-amine
CID 63556835

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-methylpropane;3-methyloxolane?
The IUPAC name of 1-methoxy-2-methylpropane;3-methyloxolane (CID 159278153) is 1-methoxy-2-methylpropane;3-methyloxolane.
What is the SMILES notation for 1-methoxy-2-methylpropane;3-methyloxolane?
The canonical SMILES for 1-methoxy-2-methylpropane;3-methyloxolane is CC1CCOC1.COCC(C)C.
What is the InChIKey of 1-methoxy-2-methylpropane;3-methyloxolane?
The InChIKey is KYOOJLCBSULXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O.C5H12O/c1-5-2-3-6-4-5;1-5(2)4-6-3/h5H,2-4H2,1H3;5H,4H2,1-3H3.
What are the key properties of 1-methoxy-2-methylpropane;3-methyloxolane?
1-methoxy-2-methylpropane;3-methyloxolane has a molecular weight of 174.28 g/mol, XLogP of 2.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-methylpropane;3-methyloxolane is sourced from PubChem (CID 159278153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).