(2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane

C15H26O2 — CID 102572280

IUPAC(2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane
SMILESCC(C)[C@@H]1O[C@H](C(C)C)[C@@](C)(C2=CCCC2)O1
InChIInChI=1S/C15H26O2/c1-10(2)13-15(5,12-8-6-7-9-12)17-14(16-13)11(3)4/h8,10-11,13-14H,6-7,9H2,1-5H3/t13-,14-,15-/m1/s1
InChIKeySEBABEQHDRVRTR-RBSFLKMASA-N
MW238.37 g/mol
LogP3.91
Rot. Bonds3

About (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane

(2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane (PubChem CID 102572280) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane.

Molecular Properties

Compound Name(2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane
PubChem CID102572280
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name(2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane
SMILESCC(C)[C@@H]1O[C@H](C(C)C)[C@@](C)(C2=CCCC2)O1
InChIInChI=1S/C15H26O2/c1-10(2)13-15(5,12-8-6-7-9-12)17-14(16-13)11(3)4/h8,10-11,13-14H,6-7,9H2,1-5H3/t13-,14-,15-/m1/s1
InChIKeySEBABEQHDRVRTR-RBSFLKMASA-N
XLogP3.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane?
The IUPAC name of (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane (CID 102572280) is (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane.
What is the SMILES notation for (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane?
The canonical SMILES for (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane is CC(C)[C@@H]1O[C@H](C(C)C)[C@@](C)(C2=CCCC2)O1.
What is the InChIKey of (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane?
The InChIKey is SEBABEQHDRVRTR-RBSFLKMASA-N. The full InChI is InChI=1S/C15H26O2/c1-10(2)13-15(5,12-8-6-7-9-12)17-14(16-13)11(3)4/h8,10-11,13-14H,6-7,9H2,1-5H3/t13-,14-,15-/m1/s1.
What are the key properties of (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane?
(2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane has a molecular weight of 238.37 g/mol, XLogP of 3.91, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R,5R)-4-(cyclopenten-1-yl)-4-methyl-2,5-di(propan-2-yl)-1,3-dioxolane is sourced from PubChem (CID 102572280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).