N-(methoxymethyl)-2-methylpropanamide

C6H13NO2 — CID 13050067

IUPACN-(methoxymethyl)-2-methylpropanamide
SMILESCOCNC(=O)C(C)C
InChIInChI=1S/C6H13NO2/c1-5(2)6(8)7-4-9-3/h5H,4H2,1-3H3,(H,7,8)
InChIKeyJFAJHHMQWRAKDS-UHFFFAOYSA-N
MW131.18 g/mol
LogP0.36
Rot. Bonds3

About N-(methoxymethyl)-2-methylpropanamide

N-(methoxymethyl)-2-methylpropanamide (PubChem CID 13050067) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is N-(methoxymethyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(methoxymethyl)-2-methylpropanamide
PubChem CID13050067
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC NameN-(methoxymethyl)-2-methylpropanamide
SMILESCOCNC(=O)C(C)C
InChIInChI=1S/C6H13NO2/c1-5(2)6(8)7-4-9-3/h5H,4H2,1-3H3,(H,7,8)
InChIKeyJFAJHHMQWRAKDS-UHFFFAOYSA-N
XLogP0.36
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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)-2-methylpropanamide?
The IUPAC name of N-(methoxymethyl)-2-methylpropanamide (CID 13050067) is N-(methoxymethyl)-2-methylpropanamide.
What is the SMILES notation for N-(methoxymethyl)-2-methylpropanamide?
The canonical SMILES for N-(methoxymethyl)-2-methylpropanamide is COCNC(=O)C(C)C.
What is the InChIKey of N-(methoxymethyl)-2-methylpropanamide?
The InChIKey is JFAJHHMQWRAKDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-5(2)6(8)7-4-9-3/h5H,4H2,1-3H3,(H,7,8).
What are the key properties of N-(methoxymethyl)-2-methylpropanamide?
N-(methoxymethyl)-2-methylpropanamide has a molecular weight of 131.18 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methoxymethyl)-2-methylpropanamide is sourced from PubChem (CID 13050067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).