1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine

C10H28ClNOSi3 — CID 173029071

IUPAC1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine
SMILESCCC(CO[SiH2]Cl)N([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C10H28ClNOSi3/c1-8-10(9-13-14-11)12(15(2,3)4)16(5,6)7/h10H,8-9,14H2,1-7H3
InChIKeyHKDFCRWTGOUWJH-UHFFFAOYSA-N
MW298.05 g/mol
LogP2.99
Rot. Bonds7

About 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine

1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine (PubChem CID 173029071) has the molecular formula C10H28ClNOSi3 and a molecular weight of 298.05 g/mol. Its IUPAC name is 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine.

Molecular Properties

Compound Name1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine
PubChem CID173029071
Molecular FormulaC10H28ClNOSi3
Molecular Weight298.05 g/mol
Exact Mass297.12
IUPAC Name1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine
SMILESCCC(CO[SiH2]Cl)N([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C10H28ClNOSi3/c1-8-10(9-13-14-11)12(15(2,3)4)16(5,6)7/h10H,8-9,14H2,1-7H3
InChIKeyHKDFCRWTGOUWJH-UHFFFAOYSA-N
XLogP2.99
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.05
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine?
The IUPAC name of 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine (CID 173029071) is 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine.
What is the SMILES notation for 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine?
The canonical SMILES for 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine is CCC(CO[SiH2]Cl)N([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine?
The InChIKey is HKDFCRWTGOUWJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H28ClNOSi3/c1-8-10(9-13-14-11)12(15(2,3)4)16(5,6)7/h10H,8-9,14H2,1-7H3.
What are the key properties of 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine?
1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine has a molecular weight of 298.05 g/mol, XLogP of 2.99, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chlorosilyloxy-N,N-bis(trimethylsilyl)butan-2-amine is sourced from PubChem (CID 173029071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).