N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide

C9H17NO3 — CID 110696561

IUPACN-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide
SMILESCOCCNC(=O)CC1CCCO1
InChIInChI=1S/C9H17NO3/c1-12-6-4-10-9(11)7-8-3-2-5-13-8/h8H,2-7H2,1H3,(H,10,11)
InChIKeyCNIWEPLKDOHZNQ-UHFFFAOYSA-N
MW187.24 g/mol
LogP0.32
Rot. Bonds5

About N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide

N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide (PubChem CID 110696561) has the molecular formula C9H17NO3 and a molecular weight of 187.24 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide
PubChem CID110696561
Molecular FormulaC9H17NO3
Molecular Weight187.24 g/mol
Exact Mass187.12
IUPAC NameN-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide
SMILESCOCCNC(=O)CC1CCCO1
InChIInChI=1S/C9H17NO3/c1-12-6-4-10-9(11)7-8-3-2-5-13-8/h8H,2-7H2,1H3,(H,10,11)
InChIKeyCNIWEPLKDOHZNQ-UHFFFAOYSA-N
XLogP0.32
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-2-(oxan-2-yl)acetamide
CID 110407614
N-(2-methoxyethyl)-N'-(oxolan-2-ylmethyl)propanediamide
CID 108943055
N-(2-acetamidoethyl)-2-(oxolan-2-yl)acetamide
CID 110696614
2-(2-methoxyethylamino)-N-(oxolan-2-ylmethyl)acetamide;hydrochloride
CID 119670121
N-[2-(4-aminocyclohexyl)oxyethyl]-2-(oxolan-2-yl)acetamide
CID 65160094
2-(oxolan-2-yl)-N-(oxolan-2-ylmethyl)acetamide
CID 110696563
4-methoxy-1-(oxolan-2-yl)butan-2-one
CID 62620585
2-(2-methoxyethylamino)-N-(oxan-2-ylmethyl)acetamide
CID 79281834
N-(5-bromopentyl)-2-(oxolan-2-yl)acetamide
CID 107321758
N-[2-(2-methoxyethylamino)-2-oxoethyl]oxolane-2-carboxamide
CID 112991151
N-(5-bromo-4-methylpentyl)-2-(oxolan-2-yl)acetamide
CID 106157924
2-(oxolan-2-yl)-N-prop-2-ynylacetamide
CID 60769102

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide (CID 110696561) is N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide is COCCNC(=O)CC1CCCO1.
What is the InChIKey of N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide?
The InChIKey is CNIWEPLKDOHZNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO3/c1-12-6-4-10-9(11)7-8-3-2-5-13-8/h8H,2-7H2,1H3,(H,10,11).
What are the key properties of N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide?
N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide has a molecular weight of 187.24 g/mol, XLogP of 0.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide is sourced from PubChem (CID 110696561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).