N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide

C9H17NO4 — CID 10888981

IUPACN-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide
SMILESCOC1CCC(CNC(C)=O)(OC)O1
InChIInChI=1S/C9H17NO4/c1-7(11)10-6-9(13-3)5-4-8(12-2)14-9/h8H,4-6H2,1-3H3,(H,10,11)
InChIKeyVPKUNEKIPAJXQF-UHFFFAOYSA-N
MW203.24 g/mol
LogP0.25
Rot. Bonds4

About N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide

N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide (PubChem CID 10888981) has the molecular formula C9H17NO4 and a molecular weight of 203.24 g/mol. Its IUPAC name is N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide
PubChem CID10888981
Molecular FormulaC9H17NO4
Molecular Weight203.24 g/mol
Exact Mass203.12
IUPAC NameN-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide
SMILESCOC1CCC(CNC(C)=O)(OC)O1
InChIInChI=1S/C9H17NO4/c1-7(11)10-6-9(13-3)5-4-8(12-2)14-9/h8H,4-6H2,1-3H3,(H,10,11)
InChIKeyVPKUNEKIPAJXQF-UHFFFAOYSA-N
XLogP0.25
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide?
The IUPAC name of N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide (CID 10888981) is N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide.
What is the SMILES notation for N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide?
The canonical SMILES for N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide is COC1CCC(CNC(C)=O)(OC)O1.
What is the InChIKey of N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide?
The InChIKey is VPKUNEKIPAJXQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO4/c1-7(11)10-6-9(13-3)5-4-8(12-2)14-9/h8H,4-6H2,1-3H3,(H,10,11).
What are the key properties of N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide?
N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide has a molecular weight of 203.24 g/mol, XLogP of 0.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dimethoxyoxolan-2-yl)methyl]acetamide is sourced from PubChem (CID 10888981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).