CID 58434340

C15H26NO6 — CID 58434340

IUPAC—
SMILESCC(O)C(=O)OC(C)C(=O)OC1CC(C)(C)N([O])C(C)(C)C1
InChIInChI=1S/C15H26NO6/c1-9(17)12(18)21-10(2)13(19)22-11-7-14(3,4)16(20)15(5,6)8-11/h9-11,17H,7-8H2,1-6H3
InChIKeyLVXOYTZINHXKQX-UHFFFAOYSA-N
MW316.37 g/mol
LogP1.21
Rot. Bonds4

About CID 58434340

CID 58434340 (PubChem CID 58434340) has the molecular formula C15H26NO6 and a molecular weight of 316.37 g/mol.

Molecular Properties

Compound NameCID 58434340
PubChem CID58434340
Molecular FormulaC15H26NO6
Molecular Weight316.37 g/mol
Exact Mass316.18
IUPAC Name—
SMILESCC(O)C(=O)OC(C)C(=O)OC1CC(C)(C)N([O])C(C)(C)C1
InChIInChI=1S/C15H26NO6/c1-9(17)12(18)21-10(2)13(19)22-11-7-14(3,4)16(20)15(5,6)8-11/h9-11,17H,7-8H2,1-6H3
InChIKeyLVXOYTZINHXKQX-UHFFFAOYSA-N
XLogP1.21
TPSA95.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of CID 58434340?
The IUPAC name of CID 58434340 (CID 58434340) is not available.
What is the SMILES notation for CID 58434340?
The canonical SMILES for CID 58434340 is CC(O)C(=O)OC(C)C(=O)OC1CC(C)(C)N([O])C(C)(C)C1.
What is the InChIKey of CID 58434340?
The InChIKey is LVXOYTZINHXKQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26NO6/c1-9(17)12(18)21-10(2)13(19)22-11-7-14(3,4)16(20)15(5,6)8-11/h9-11,17H,7-8H2,1-6H3.
What are the key properties of CID 58434340?
CID 58434340 has a molecular weight of 316.37 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58434340 is sourced from PubChem (CID 58434340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).