(4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide

C16H22N2O5 — CID 134920624

IUPAC(4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide
SMILESCOC1(c2ccccc2)O[C@@H](C(=O)N(C)C)[C@H](C(=O)N(C)C)O1
InChIInChI=1S/C16H22N2O5/c1-17(2)14(19)12-13(15(20)18(3)4)23-16(21-5,22-12)11-9-7-6-8-10-11/h6-10,12-13H,1-5H3/t12-,13-/m1/s1
InChIKeyZUPCEBTWCNSMCJ-CHWSQXEVSA-N
MW322.36 g/mol
LogP0.40
Rot. Bonds4

About (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide

(4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide (PubChem CID 134920624) has the molecular formula C16H22N2O5 and a molecular weight of 322.36 g/mol. Its IUPAC name is (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide.

Molecular Properties

Compound Name(4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide
PubChem CID134920624
Molecular FormulaC16H22N2O5
Molecular Weight322.36 g/mol
Exact Mass322.15
IUPAC Name(4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide
SMILESCOC1(c2ccccc2)O[C@@H](C(=O)N(C)C)[C@H](C(=O)N(C)C)O1
InChIInChI=1S/C16H22N2O5/c1-17(2)14(19)12-13(15(20)18(3)4)23-16(21-5,22-12)11-9-7-6-8-10-11/h6-10,12-13H,1-5H3/t12-,13-/m1/s1
InChIKeyZUPCEBTWCNSMCJ-CHWSQXEVSA-N
XLogP0.40
TPSA68.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 50.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide?
The IUPAC name of (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide (CID 134920624) is (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide.
What is the SMILES notation for (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide?
The canonical SMILES for (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide is COC1(c2ccccc2)O[C@@H](C(=O)N(C)C)[C@H](C(=O)N(C)C)O1.
What is the InChIKey of (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide?
The InChIKey is ZUPCEBTWCNSMCJ-CHWSQXEVSA-N. The full InChI is InChI=1S/C16H22N2O5/c1-17(2)14(19)12-13(15(20)18(3)4)23-16(21-5,22-12)11-9-7-6-8-10-11/h6-10,12-13H,1-5H3/t12-,13-/m1/s1.
What are the key properties of (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide?
(4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide has a molecular weight of 322.36 g/mol, XLogP of 0.40, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-2-methoxy-4-N,4-N,5-N,5-N-tetramethyl-2-phenyl-1,3-dioxolane-4,5-dicarboxamide is sourced from PubChem (CID 134920624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).