3-methoxypentane;1-methoxypropane

C10H24O2 — CID 54391478

IUPAC3-methoxypentane;1-methoxypropane
SMILESCCC(CC)OC.CCCOC
InChIInChI=1S/C6H14O.C4H10O/c1-4-6(5-2)7-3;1-3-4-5-2/h6H,4-5H2,1-3H3;3-4H2,1-2H3
InChIKeyVGYKNEOTCNEAFS-UHFFFAOYSA-N
MW176.30 g/mol
LogP2.86
Rot. Bonds5

About 3-methoxypentane;1-methoxypropane

3-methoxypentane;1-methoxypropane (PubChem CID 54391478) has the molecular formula C10H24O2 and a molecular weight of 176.30 g/mol. Its IUPAC name is 3-methoxypentane;1-methoxypropane.

Molecular Properties

Compound Name3-methoxypentane;1-methoxypropane
PubChem CID54391478
Molecular FormulaC10H24O2
Molecular Weight176.30 g/mol
Exact Mass176.18
IUPAC Name3-methoxypentane;1-methoxypropane
SMILESCCC(CC)OC.CCCOC
InChIInChI=1S/C6H14O.C4H10O/c1-4-6(5-2)7-3;1-3-4-5-2/h6H,4-5H2,1-3H3;3-4H2,1-2H3
InChIKeyVGYKNEOTCNEAFS-UHFFFAOYSA-N
XLogP2.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

methane;2-methoxybutan-1-ol;2-(methoxymethyl)butan-1-ol;1-methoxypropane
CID 157097791
1-methoxypropane;propane-1,1-diol
CID 174611080
methane;1-methoxy-2-methylbutane;3-methoxypentane
CID 160866312
ethane;1-methoxypropane;propane
CID 145001283
sodium;hydride;1-methoxypropane
CID 174682746
fluoromethane;1-methoxypropane
CID 54348192
ethane;methane;methoxymethane;1-methoxypropane
CID 159822754
tetrakis(1-methoxypropane);phosphanyl-bis(sulfanyl)phosphane
CID 173157060
1,2-dimethoxybutane;1,2-dimethoxypropane
CID 91039470
1,2-dimethoxypentane
CID 22961171
(2S)-2-methoxybutan-1-amine
CID 42427147
1-chloro-2-methoxybutane
CID 20783140

Frequently Asked Questions

What is the IUPAC name of 3-methoxypentane;1-methoxypropane?
The IUPAC name of 3-methoxypentane;1-methoxypropane (CID 54391478) is 3-methoxypentane;1-methoxypropane.
What is the SMILES notation for 3-methoxypentane;1-methoxypropane?
The canonical SMILES for 3-methoxypentane;1-methoxypropane is CCC(CC)OC.CCCOC.
What is the InChIKey of 3-methoxypentane;1-methoxypropane?
The InChIKey is VGYKNEOTCNEAFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O.C4H10O/c1-4-6(5-2)7-3;1-3-4-5-2/h6H,4-5H2,1-3H3;3-4H2,1-2H3.
What are the key properties of 3-methoxypentane;1-methoxypropane?
3-methoxypentane;1-methoxypropane has a molecular weight of 176.30 g/mol, XLogP of 2.86, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxypentane;1-methoxypropane is sourced from PubChem (CID 54391478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).