N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide

C13H30N2O2Si2 — CID 91250387

IUPACN-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide
SMILESC=C(CC)NC[Si](C)(C)O[Si](C)(C)CNC(=O)CC
InChIInChI=1S/C13H30N2O2Si2/c1-8-12(3)14-10-18(4,5)17-19(6,7)11-15-13(16)9-2/h14H,3,8-11H2,1-2,4-7H3,(H,15,16)
InChIKeySKVGHMQYVQMMLG-UHFFFAOYSA-N
MW302.57 g/mol
LogP2.53
Rot. Bonds9

About N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide

N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide (PubChem CID 91250387) has the molecular formula C13H30N2O2Si2 and a molecular weight of 302.57 g/mol. Its IUPAC name is N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide.

Molecular Properties

Compound NameN-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide
PubChem CID91250387
Molecular FormulaC13H30N2O2Si2
Molecular Weight302.57 g/mol
Exact Mass302.18
IUPAC NameN-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide
SMILESC=C(CC)NC[Si](C)(C)O[Si](C)(C)CNC(=O)CC
InChIInChI=1S/C13H30N2O2Si2/c1-8-12(3)14-10-18(4,5)17-19(6,7)11-15-13(16)9-2/h14H,3,8-11H2,1-2,4-7H3,(H,15,16)
InChIKeySKVGHMQYVQMMLG-UHFFFAOYSA-N
XLogP2.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.57
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[[[dimethyl(methylaminomethyl)silyl]oxy-dimethylsilyl]methyl]-3-methylbut-3-enamide
CID 91169428
but-1-en-2-amine;N-methylpropanamide
CID 143544208

Frequently Asked Questions

What is the IUPAC name of N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide?
The IUPAC name of N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide (CID 91250387) is N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide.
What is the SMILES notation for N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide?
The canonical SMILES for N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide is C=C(CC)NC[Si](C)(C)O[Si](C)(C)CNC(=O)CC.
What is the InChIKey of N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide?
The InChIKey is SKVGHMQYVQMMLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O2Si2/c1-8-12(3)14-10-18(4,5)17-19(6,7)11-15-13(16)9-2/h14H,3,8-11H2,1-2,4-7H3,(H,15,16).
What are the key properties of N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide?
N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide has a molecular weight of 302.57 g/mol, XLogP of 2.53, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[[(but-1-en-2-ylamino)methyl-dimethylsilyl]oxy-dimethylsilyl]methyl]propanamide is sourced from PubChem (CID 91250387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).