2,2-diethyl-N-methylsilylbutanamide

C9H21NOSi — CID 123632765

IUPAC2,2-diethyl-N-methylsilylbutanamide
SMILESCCC(CC)(CC)C(=O)N[SiH2]C
InChIInChI=1S/C9H21NOSi/c1-5-9(6-2,7-3)8(11)10-12-4/h5-7,12H2,1-4H3,(H,10,11)
InChIKeyAZCHSDHXWRHAQW-UHFFFAOYSA-N
MW187.36 g/mol
LogP1.45
Rot. Bonds5

About 2,2-diethyl-N-methylsilylbutanamide

2,2-diethyl-N-methylsilylbutanamide (PubChem CID 123632765) has the molecular formula C9H21NOSi and a molecular weight of 187.36 g/mol. Its IUPAC name is 2,2-diethyl-N-methylsilylbutanamide.

Molecular Properties

Compound Name2,2-diethyl-N-methylsilylbutanamide
PubChem CID123632765
Molecular FormulaC9H21NOSi
Molecular Weight187.36 g/mol
Exact Mass187.14
IUPAC Name2,2-diethyl-N-methylsilylbutanamide
SMILESCCC(CC)(CC)C(=O)N[SiH2]C
InChIInChI=1S/C9H21NOSi/c1-5-9(6-2,7-3)8(11)10-12-4/h5-7,12H2,1-4H3,(H,10,11)
InChIKeyAZCHSDHXWRHAQW-UHFFFAOYSA-N
XLogP1.45
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.36
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2,2,2-trifluoro-N-methylsilylacetamide
CID 123916104
2-(2,2-diethylbutanoylamino)acetic acid
CID 88907471
5,5-diethyl-2,2,3,3-tetramethylheptan-4-one
CID 27874
azane;2,2-diethylbutanoic acid
CID 173369262
N-ethyl-2,2-bis(sulfanylmethyl)butanamide
CID 23104520
2-hydroxy-N,2-dimethylbutanamide
CID 22213750
2,2-diethyl-N,N',4,4-tetramethylpentanediamide
CID 123803156
3-(2,2-diethylbutanoylamino)-4,4,4-trifluorobutanoic acid
CID 88907475
acetic acid;2,2-diethylbutanoic acid
CID 162011618
2,2-diethyl-N-hydroxypentadecanamide
CID 138558527
2,2-diethyl-N-methylhexadecanamide
CID 158971138
2-(aminomethyl)-2-ethyl-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]butanamide
CID 107865773

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N-methylsilylbutanamide?
The IUPAC name of 2,2-diethyl-N-methylsilylbutanamide (CID 123632765) is 2,2-diethyl-N-methylsilylbutanamide.
What is the SMILES notation for 2,2-diethyl-N-methylsilylbutanamide?
The canonical SMILES for 2,2-diethyl-N-methylsilylbutanamide is CCC(CC)(CC)C(=O)N[SiH2]C.
What is the InChIKey of 2,2-diethyl-N-methylsilylbutanamide?
The InChIKey is AZCHSDHXWRHAQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NOSi/c1-5-9(6-2,7-3)8(11)10-12-4/h5-7,12H2,1-4H3,(H,10,11).
What are the key properties of 2,2-diethyl-N-methylsilylbutanamide?
2,2-diethyl-N-methylsilylbutanamide has a molecular weight of 187.36 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-N-methylsilylbutanamide is sourced from PubChem (CID 123632765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).