1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one

C15H29NO6 — CID 143419693

IUPAC1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one
SMILESCC.CC.O=C1CCCN1.O=C1CCCO1.O=C1OCCO1
InChIInChI=1S/C4H7NO.C4H6O2.C3H4O3.2C2H6/c6-4-2-1-3-5-4;5-4-2-1-3-6-4;4-3-5-1-2-6-3;2*1-2/h1-3H2,(H,5,6);1-3H2;1-2H2;2*1-2H3
InChIKeyFHBBLTOHSUZVOK-UHFFFAOYSA-N
MW319.40 g/mol
LogP2.43
Rot. Bonds

About 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one

1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one (PubChem CID 143419693) has the molecular formula C15H29NO6 and a molecular weight of 319.40 g/mol. Its IUPAC name is 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one.

Molecular Properties

Compound Name1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one
PubChem CID143419693
Molecular FormulaC15H29NO6
Molecular Weight319.40 g/mol
Exact Mass319.20
IUPAC Name1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one
SMILESCC.CC.O=C1CCCN1.O=C1CCCO1.O=C1OCCO1
InChIInChI=1S/C4H7NO.C4H6O2.C3H4O3.2C2H6/c6-4-2-1-3-5-4;5-4-2-1-3-6-4;4-3-5-1-2-6-3;2*1-2/h1-3H2,(H,5,6);1-3H2;1-2H2;2*1-2H3
InChIKeyFHBBLTOHSUZVOK-UHFFFAOYSA-N
XLogP2.43
TPSA90.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one 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

ethane;pyrrolidin-2-one
CID 54451151
1,5-dioxa-10,13-diazacycloheptadecane-6,9,14,17-tetrone
CID 594066
oxolan-2-one;yttrium
CID 157257098
(213C)oxolan-2-one
CID 175700736
astatane;pyrrolidin-2-one
CID 174831438
arsane;pyrrolidin-2-one
CID 174413202
oxolan-2-one;silver
CID 175854718
pyrrolidin-2-one;hydrate
CID 19382566
benzene;cyclohexane;ethane;pyrrolidin-2-one
CID 157259097
azepan-2-one;ethane
CID 91592472
oxolan-2-one;propane
CID 91446607
oxolan-2-one;hydrate;hydrochloride
CID 174376382

Frequently Asked Questions

What is the IUPAC name of 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one?
The IUPAC name of 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one (CID 143419693) is 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one.
What is the SMILES notation for 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one?
The canonical SMILES for 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one is CC.CC.O=C1CCCN1.O=C1CCCO1.O=C1OCCO1.
What is the InChIKey of 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one?
The InChIKey is FHBBLTOHSUZVOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO.C4H6O2.C3H4O3.2C2H6/c6-4-2-1-3-5-4;5-4-2-1-3-6-4;4-3-5-1-2-6-3;2*1-2/h1-3H2,(H,5,6);1-3H2;1-2H2;2*1-2H3.
What are the key properties of 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one?
1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one has a molecular weight of 319.40 g/mol, XLogP of 2.43, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dioxolan-2-one;ethane;oxolan-2-one;pyrrolidin-2-one is sourced from PubChem (CID 143419693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).