dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate

C14H26O6 — CID 139989252

IUPACdipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate
SMILESCOC(C)(C(=O)OC(C)C)C(C)(OC)C(=O)OC(C)C
InChIInChI=1S/C14H26O6/c1-9(2)19-11(15)13(5,17-7)14(6,18-8)12(16)20-10(3)4/h9-10H,1-8H3
InChIKeyUQXVXZJRMQRYGL-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.70
Rot. Bonds7

About dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate

dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate (PubChem CID 139989252) has the molecular formula C14H26O6 and a molecular weight of 290.36 g/mol. Its IUPAC name is dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate.

Molecular Properties

Compound Namedipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate
PubChem CID139989252
Molecular FormulaC14H26O6
Molecular Weight290.36 g/mol
Exact Mass290.17
IUPAC Namedipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate
SMILESCOC(C)(C(=O)OC(C)C)C(C)(OC)C(=O)OC(C)C
InChIInChI=1S/C14H26O6/c1-9(2)19-11(15)13(5,17-7)14(6,18-8)12(16)20-10(3)4/h9-10H,1-8H3
InChIKeyUQXVXZJRMQRYGL-UHFFFAOYSA-N
XLogP1.70
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate 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

dibutan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate
CID 139989360
dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate
CID 151999350
propan-2-yl 2,2-dichloro-3-methylbutanoate
CID 57232967
propan-2-yl 2,2,2-tribromoacetate
CID 6432844
propan-2-yl 2-amino-2,3-dimethylbutanoate
CID 18780772
propan-2-yl 2-amino-2-sulfanylpropanoate
CID 123998994
propan-2-yl 3,4-dimethyl-2,2,3-tri(propan-2-yl)pentanoate
CID 173451742
methane;propan-2-yl 2-methyl-2-(methylamino)propanoate
CID 167683486
2-hydroxy-2-methylpropanoic acid;propan-2-ol;propan-2-yl 2-hydroxy-2-methylpropanoate
CID 159782312
propan-2-yl 2-ethyl-2,3-dimethylbutanoate
CID 87568455
propan-2-yl 2-amino-3,3,3-trifluoro-2-methylpropanoate
CID 79798173
propan-2-yl 2-methyl-2-propylpentanoate
CID 118411405

Frequently Asked Questions

What is the IUPAC name of dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate?
The IUPAC name of dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate (CID 139989252) is dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate.
What is the SMILES notation for dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate?
The canonical SMILES for dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate is COC(C)(C(=O)OC(C)C)C(C)(OC)C(=O)OC(C)C.
What is the InChIKey of dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate?
The InChIKey is UQXVXZJRMQRYGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O6/c1-9(2)19-11(15)13(5,17-7)14(6,18-8)12(16)20-10(3)4/h9-10H,1-8H3.
What are the key properties of dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate?
dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate has a molecular weight of 290.36 g/mol, XLogP of 1.70, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate is sourced from PubChem (CID 139989252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).