methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate

C10H18O4 — CID 13052825

IUPACmethyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate
SMILESCOC(=O)C1(OC)CCC(C(C)C)O1
InChIInChI=1S/C10H18O4/c1-7(2)8-5-6-10(13-4,14-8)9(11)12-3/h7-8H,5-6H2,1-4H3
InChIKeyPIQZODYBULUZJG-UHFFFAOYSA-N
MW202.25 g/mol
LogP1.34
Rot. Bonds3

About methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate

methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate (PubChem CID 13052825) has the molecular formula C10H18O4 and a molecular weight of 202.25 g/mol. Its IUPAC name is methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate.

Molecular Properties

Compound Namemethyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate
PubChem CID13052825
Molecular FormulaC10H18O4
Molecular Weight202.25 g/mol
Exact Mass202.12
IUPAC Namemethyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate
SMILESCOC(=O)C1(OC)CCC(C(C)C)O1
InChIInChI=1S/C10H18O4/c1-7(2)8-5-6-10(13-4,14-8)9(11)12-3/h7-8H,5-6H2,1-4H3
InChIKeyPIQZODYBULUZJG-UHFFFAOYSA-N
XLogP1.34
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate 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

Ethyl 2-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-methoxypropanoate
CID 135038660
5-Ethyl-2-methoxy-tetrahydro-furan-2-carboxylic acid methyl ester
CID 13052824
1,3-Dioxolan-4-one, 2-t-butyl-5-methyl-5-(4,4-dimethoxypentyl)-
CID 538301
2-Propylhexyl 3-(5-ethyl-2-oxo-1,3-dioxolan-4-yl)propanoate
CID 23573575
dimethyl (3S,4R,6R)-2-(2-methylpropyl)-1,7-dioxaspiro[2.4]heptane-4,6-dicarboxylate
CID 57235148
1-[2-Methyl-4-[2-methyl-2-(2-methylpropyl)-1,3-dioxolan-4-yl]oxolan-2-yl]ethanone
CID 58219228
(3S)-3-methyl-5-[(4R,5R)-2,2,5-trimethyl-1,3-dioxolan-4-yl]oxolan-2-one
CID 68035040
(2R)-2-[[(4S)-2,2-dimethyl-5-oxo-1,3-dioxolan-4-yl]methyl]pentanoic acid
CID 68822040
Methyl 4-[5-methoxycarbonyl-2-(2-methoxycarbonyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane-2-carboxylate
CID 70801957
methyl (2R,4S,5R,6R)-2-acetyloxy-6-[(2R,3S)-4-acetyloxy-3-methylbutan-2-yl]-4,5-dimethyloxane-2-carboxylate
CID 90276092
Butyl 8-ethoxy-1,4-dioxaspiro[4.5]decane-8-carboxylate
CID 90368252
Bis(7-methyloctyl) oxolane-2,5-dicarboxylate
CID 122422622

Frequently Asked Questions

What is the IUPAC name of methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate?
The IUPAC name of methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate (CID 13052825) is methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate.
What is the SMILES notation for methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate?
The canonical SMILES for methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate is COC(=O)C1(OC)CCC(C(C)C)O1.
What is the InChIKey of methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate?
The InChIKey is PIQZODYBULUZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O4/c1-7(2)8-5-6-10(13-4,14-8)9(11)12-3/h7-8H,5-6H2,1-4H3.
What are the key properties of methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate?
methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate has a molecular weight of 202.25 g/mol, XLogP of 1.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methoxy-5-propan-2-yloxolane-2-carboxylate is sourced from PubChem (CID 13052825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).