methanol;N-methylacetamide

C4H11NO2 — CID 22729134

IUPACmethanol;N-methylacetamide
SMILESCNC(C)=O.CO
InChIInChI=1S/C3H7NO.CH4O/c1-3(5)4-2;1-2/h1-2H3,(H,4,5);2H,1H3
InChIKeyLAHVUCXSIXNWNS-UHFFFAOYSA-N
MW105.14 g/mol
LogP-0.64
Rot. Bonds

About methanol;N-methylacetamide

methanol;N-methylacetamide (PubChem CID 22729134) has the molecular formula C4H11NO2 and a molecular weight of 105.14 g/mol. Its IUPAC name is methanol;N-methylacetamide.

Molecular Properties

Compound Namemethanol;N-methylacetamide
PubChem CID22729134
Molecular FormulaC4H11NO2
Molecular Weight105.14 g/mol
Exact Mass105.08
IUPAC Namemethanol;N-methylacetamide
SMILESCNC(C)=O.CO
InChIInChI=1S/C3H7NO.CH4O/c1-3(5)4-2;1-2/h1-2H3,(H,4,5);2H,1H3
InChIKeyLAHVUCXSIXNWNS-UHFFFAOYSA-N
XLogP-0.64
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.14
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methanol;N-methylacetamide?
The IUPAC name of methanol;N-methylacetamide (CID 22729134) is methanol;N-methylacetamide.
What is the SMILES notation for methanol;N-methylacetamide?
The canonical SMILES for methanol;N-methylacetamide is CNC(C)=O.CO.
What is the InChIKey of methanol;N-methylacetamide?
The InChIKey is LAHVUCXSIXNWNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.CH4O/c1-3(5)4-2;1-2/h1-2H3,(H,4,5);2H,1H3.
What are the key properties of methanol;N-methylacetamide?
methanol;N-methylacetamide has a molecular weight of 105.14 g/mol, XLogP of -0.64, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;N-methylacetamide is sourced from PubChem (CID 22729134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).