N-methoxy-N,3-dimethylbutanamide

C7H15NO2 — CID 10975620

IUPACN-methoxy-N,3-dimethylbutanamide
SMILESCON(C)C(=O)CC(C)C
InChIInChI=1S/C7H15NO2/c1-6(2)5-7(9)8(3)10-4/h6H,5H2,1-4H3
InChIKeyXRMRJHNLKBFKFF-UHFFFAOYSA-N
MW145.20 g/mol
LogP1.05
Rot. Bonds3

About N-methoxy-N,3-dimethylbutanamide

N-methoxy-N,3-dimethylbutanamide (PubChem CID 10975620) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is N-methoxy-N,3-dimethylbutanamide.

Molecular Properties

Compound NameN-methoxy-N,3-dimethylbutanamide
PubChem CID10975620
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC NameN-methoxy-N,3-dimethylbutanamide
SMILESCON(C)C(=O)CC(C)C
InChIInChI=1S/C7H15NO2/c1-6(2)5-7(9)8(3)10-4/h6H,5H2,1-4H3
InChIKeyXRMRJHNLKBFKFF-UHFFFAOYSA-N
XLogP1.05
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-hydroxy-N-methoxy-N-methylbutanamide
CID 73159357
(3R)-4,4,4-trichloro-3-hydroxy-N-methoxy-N-methylbutanamide
CID 11543342
(3R)-3-hydroxy-N-methoxy-N-methylpent-4-enamide
CID 25259472
N-methoxy-N-methylpropanamide
CID 11344007
N-methoxy-N-methyl-3-phenylbutanamide
CID 22612044
4-(4-chlorophenyl)-N-methoxy-N,3-dimethylbutanamide
CID 158982975
tert-butyl N-[(3R)-1-[methoxy(methyl)amino]-4-methyl-1-oxopentan-3-yl]-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate
CID 24824435
tert-butyl 2-amino-4-[methoxy(methyl)amino]-4-oxobutanoate
CID 90348684
[1-[methoxy(methyl)amino]-4,4-dimethyl-1-oxopentan-3-yl]-methylcarbamic acid
CID 170338570
tert-butyl N-[(3R)-1-[methoxy(methyl)amino]-4-methyl-1-oxopentan-3-yl]carbamate
CID 24824434
(3R)-3-[(1R,3S)-3-hydroxycyclopentyl]-N-methoxy-N-methylbutanamide
CID 11095992
N-ethyl-N,3-dimethylbutanamide
CID 18505916

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N,3-dimethylbutanamide?
The IUPAC name of N-methoxy-N,3-dimethylbutanamide (CID 10975620) is N-methoxy-N,3-dimethylbutanamide.
What is the SMILES notation for N-methoxy-N,3-dimethylbutanamide?
The canonical SMILES for N-methoxy-N,3-dimethylbutanamide is CON(C)C(=O)CC(C)C.
What is the InChIKey of N-methoxy-N,3-dimethylbutanamide?
The InChIKey is XRMRJHNLKBFKFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-6(2)5-7(9)8(3)10-4/h6H,5H2,1-4H3.
What are the key properties of N-methoxy-N,3-dimethylbutanamide?
N-methoxy-N,3-dimethylbutanamide has a molecular weight of 145.20 g/mol, XLogP of 1.05, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N,3-dimethylbutanamide is sourced from PubChem (CID 10975620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).