N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide

C19H39N3O3Si — CID 87222114

IUPACN-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide
SMILESCCCCN(C(C)=O)[Si](C)(N(CCCC)C(C)=O)N(CCCC)C(C)=O
InChIInChI=1S/C19H39N3O3Si/c1-8-11-14-20(17(4)23)26(7,21(18(5)24)15-12-9-2)22(19(6)25)16-13-10-3/h8-16H2,1-7H3
InChIKeyGFJAHEQHAFJVQN-UHFFFAOYSA-N
MW385.63 g/mol
LogP3.50
Rot. Bonds12

About N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide

N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide (PubChem CID 87222114) has the molecular formula C19H39N3O3Si and a molecular weight of 385.63 g/mol. Its IUPAC name is N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide.

Molecular Properties

Compound NameN-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide
PubChem CID87222114
Molecular FormulaC19H39N3O3Si
Molecular Weight385.63 g/mol
Exact Mass385.28
IUPAC NameN-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide
SMILESCCCCN(C(C)=O)[Si](C)(N(CCCC)C(C)=O)N(CCCC)C(C)=O
InChIInChI=1S/C19H39N3O3Si/c1-8-11-14-20(17(4)23)26(7,21(18(5)24)15-12-9-2)22(19(6)25)16-13-10-3/h8-16H2,1-7H3
InChIKeyGFJAHEQHAFJVQN-UHFFFAOYSA-N
XLogP3.50
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.63
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-N-iodoacetamide
CID 18767604
N-butyl-N-methylacetamide;ethane
CID 142088805
[[carboxy(hexyl)amino]-dimethylsilyl]-hexylcarbamic acid
CID 87274885
N-butyl-N-heptylacetamide
CID 91713167
N-pent-4-enyl-N-trimethylsilylacetamide
CID 10058602
N'-acetyl-N'-butylacetohydrazide
CID 141194485
N-(2-bromoethyl)-N-butylacetamide
CID 80659482
N-butyl-N-methylsulfonylacetamide
CID 45377177
N-acetyl-N-decylacetamide
CID 57029087
N,N-di(icosyl)acetamide
CID 57063838
N-heptadecyl-N-tridecylacetamide
CID 172567567
N,N-di(pentadecyl)acetamide
CID 174726671

Frequently Asked Questions

What is the IUPAC name of N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide?
The IUPAC name of N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide (CID 87222114) is N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide.
What is the SMILES notation for N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide?
The canonical SMILES for N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide is CCCCN(C(C)=O)[Si](C)(N(CCCC)C(C)=O)N(CCCC)C(C)=O.
What is the InChIKey of N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide?
The InChIKey is GFJAHEQHAFJVQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39N3O3Si/c1-8-11-14-20(17(4)23)26(7,21(18(5)24)15-12-9-2)22(19(6)25)16-13-10-3/h8-16H2,1-7H3.
What are the key properties of N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide?
N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide has a molecular weight of 385.63 g/mol, XLogP of 3.50, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis[acetyl(butyl)amino]-methylsilyl]-N-butylacetamide is sourced from PubChem (CID 87222114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).