N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine

C14H34ClNSi2 — CID 87773982

IUPACN-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine
SMILESCC(C)(CCl)CN([Si](C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H34ClNSi2/c1-13(2,3)18(9,10)16(17(6,7)8)12-14(4,5)11-15/h11-12H2,1-10H3
InChIKeyKMPSVKSAAPXIKT-UHFFFAOYSA-N
MW308.06 g/mol
LogP5.39
Rot. Bonds5

About N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine

N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine (PubChem CID 87773982) has the molecular formula C14H34ClNSi2 and a molecular weight of 308.06 g/mol. Its IUPAC name is N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine.

Molecular Properties

Compound NameN-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine
PubChem CID87773982
Molecular FormulaC14H34ClNSi2
Molecular Weight308.06 g/mol
Exact Mass307.19
IUPAC NameN-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine
SMILESCC(C)(CCl)CN([Si](C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H34ClNSi2/c1-13(2,3)18(9,10)16(17(6,7)8)12-14(4,5)11-15/h11-12H2,1-10H3
InChIKeyKMPSVKSAAPXIKT-UHFFFAOYSA-N
XLogP5.39
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.06
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine?
The IUPAC name of N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine (CID 87773982) is N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine.
What is the SMILES notation for N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine?
The canonical SMILES for N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine is CC(C)(CCl)CN([Si](C)(C)C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine?
The InChIKey is KMPSVKSAAPXIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H34ClNSi2/c1-13(2,3)18(9,10)16(17(6,7)8)12-14(4,5)11-15/h11-12H2,1-10H3.
What are the key properties of N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine?
N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine has a molecular weight of 308.06 g/mol, XLogP of 5.39, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[tert-butyl(dimethyl)silyl]-3-chloro-2,2-dimethyl-N-trimethylsilylpropan-1-amine is sourced from PubChem (CID 87773982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).