3,3-bis(methoxymethyl)-2-methylpentane

C10H22O2 — CID 89106557

IUPAC3,3-bis(methoxymethyl)-2-methylpentane
SMILESCCC(COC)(COC)C(C)C
InChIInChI=1S/C10H22O2/c1-6-10(7-11-4,8-12-5)9(2)3/h9H,6-8H2,1-5H3
InChIKeyLQDWCKFDZIHRPV-UHFFFAOYSA-N
MW174.28 g/mol
LogP2.33
Rot. Bonds6

About 3,3-bis(methoxymethyl)-2-methylpentane

3,3-bis(methoxymethyl)-2-methylpentane (PubChem CID 89106557) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is 3,3-bis(methoxymethyl)-2-methylpentane.

Molecular Properties

Compound Name3,3-bis(methoxymethyl)-2-methylpentane
PubChem CID89106557
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Name3,3-bis(methoxymethyl)-2-methylpentane
SMILESCCC(COC)(COC)C(C)C
InChIInChI=1S/C10H22O2/c1-6-10(7-11-4,8-12-5)9(2)3/h9H,6-8H2,1-5H3
InChIKeyLQDWCKFDZIHRPV-UHFFFAOYSA-N
XLogP2.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
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

Analyze 3,3-bis(methoxymethyl)-2-methylpentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-bromo-2-(bromomethyl)-2-(methoxymethyl)-3-methylbutane
CID 103985334
3,3-diethyl-2-methylpentane;ethane
CID 163394660
2-(methoxymethyl)-N,N-dimethyl-2-propan-2-ylpentan-1-amine
CID 139968966
N,N-diethyl-2-(methoxymethyl)-4-methyl-2-propan-2-ylpentan-1-amine
CID 139968885
2-(methoxymethyl)-2-propan-2-yldecan-1-amine
CID 139968822
3,3-bis(methoxymethyl)-2,6-dimethylheptane;3,3-bis(methoxymethyl)-2,4-dimethylpentane
CID 22373213
3-(methoxymethyl)-6-methyl-3-propan-2-ylheptan-1-ol
CID 170393196
2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine
CID 139968931
3,3-diethyl-2-methyldodecane
CID 151072312
3,4-diethyl-3,4-bis(methoxymethyl)hexane
CID 22153406
3-methoxy-3-(methoxymethyl)-2,4-dimethylpentane
CID 23384967
4,4-bis(methoxymethyl)-3,7-dimethylnonane
CID 177251110

Frequently Asked Questions

What is the IUPAC name of 3,3-bis(methoxymethyl)-2-methylpentane?
The IUPAC name of 3,3-bis(methoxymethyl)-2-methylpentane (CID 89106557) is 3,3-bis(methoxymethyl)-2-methylpentane.
What is the SMILES notation for 3,3-bis(methoxymethyl)-2-methylpentane?
The canonical SMILES for 3,3-bis(methoxymethyl)-2-methylpentane is CCC(COC)(COC)C(C)C.
What is the InChIKey of 3,3-bis(methoxymethyl)-2-methylpentane?
The InChIKey is LQDWCKFDZIHRPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2/c1-6-10(7-11-4,8-12-5)9(2)3/h9H,6-8H2,1-5H3.
What are the key properties of 3,3-bis(methoxymethyl)-2-methylpentane?
3,3-bis(methoxymethyl)-2-methylpentane has a molecular weight of 174.28 g/mol, XLogP of 2.33, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-bis(methoxymethyl)-2-methylpentane is sourced from PubChem (CID 89106557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).