N-(methoxymethyl)-N-methylformamide

C4H9NO2 — CID 560292

IUPACN-(methoxymethyl)-N-methylformamide
SMILESCOCN(C)C=O
InChIInChI=1S/C4H9NO2/c1-5(3-6)4-7-2/h3H,4H2,1-2H3
InChIKeyAITXBHMOGHXWFR-UHFFFAOYSA-N
MW103.12 g/mol
LogP-0.32
Rot. Bonds3

About N-(methoxymethyl)-N-methylformamide

N-(methoxymethyl)-N-methylformamide (PubChem CID 560292) has the molecular formula C4H9NO2 and a molecular weight of 103.12 g/mol. Its IUPAC name is N-(methoxymethyl)-N-methylformamide.

Molecular Properties

Compound NameN-(methoxymethyl)-N-methylformamide
PubChem CID560292
Molecular FormulaC4H9NO2
Molecular Weight103.12 g/mol
Exact Mass103.06
IUPAC NameN-(methoxymethyl)-N-methylformamide
SMILESCOCN(C)C=O
InChIInChI=1S/C4H9NO2/c1-5(3-6)4-7-2/h3H,4H2,1-2H3
InChIKeyAITXBHMOGHXWFR-UHFFFAOYSA-N
XLogP-0.32
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.12
LogP ≤ 5-0.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(methoxymethyl)-N-methylformamide?
The IUPAC name of N-(methoxymethyl)-N-methylformamide (CID 560292) is N-(methoxymethyl)-N-methylformamide.
What is the SMILES notation for N-(methoxymethyl)-N-methylformamide?
The canonical SMILES for N-(methoxymethyl)-N-methylformamide is COCN(C)C=O.
What is the InChIKey of N-(methoxymethyl)-N-methylformamide?
The InChIKey is AITXBHMOGHXWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2/c1-5(3-6)4-7-2/h3H,4H2,1-2H3.
What are the key properties of N-(methoxymethyl)-N-methylformamide?
N-(methoxymethyl)-N-methylformamide has a molecular weight of 103.12 g/mol, XLogP of -0.32, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methoxymethyl)-N-methylformamide is sourced from PubChem (CID 560292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).