1-dichlorosilylbutan-2-amine

C4H11Cl2NSi — CID 173003363

IUPAC1-dichlorosilylbutan-2-amine
SMILESCCC(N)C[SiH](Cl)Cl
InChIInChI=1S/C4H11Cl2NSi/c1-2-4(7)3-8(5)6/h4,8H,2-3,7H2,1H3
InChIKeyNUWSKWWKEOAQSS-UHFFFAOYSA-N
MW172.13 g/mol
LogP1.42
Rot. Bonds3

About 1-dichlorosilylbutan-2-amine

1-dichlorosilylbutan-2-amine (PubChem CID 173003363) has the molecular formula C4H11Cl2NSi and a molecular weight of 172.13 g/mol. Its IUPAC name is 1-dichlorosilylbutan-2-amine.

Molecular Properties

Compound Name1-dichlorosilylbutan-2-amine
PubChem CID173003363
Molecular FormulaC4H11Cl2NSi
Molecular Weight172.13 g/mol
Exact Mass171.00
IUPAC Name1-dichlorosilylbutan-2-amine
SMILESCCC(N)C[SiH](Cl)Cl
InChIInChI=1S/C4H11Cl2NSi/c1-2-4(7)3-8(5)6/h4,8H,2-3,7H2,1H3
InChIKeyNUWSKWWKEOAQSS-UHFFFAOYSA-N
XLogP1.42
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.13
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Aminopropyltriclorosilane
CID 22242406
3-(Dichloroethylsilyl)propylamine
CID 20836280
1-Trichlorosilylbutan-1-amine
CID 21459383
3-[Dichloro(methyl)silyl]propan-1-amine
CID 55255907
N-[butyl(dichloro)silyl]ethanamine
CID 87334493
N-[butan-2-yl(dichloro)silyl]ethanamine
CID 87335531
N-[dichloro(propyl)silyl]ethanamine
CID 87335603
N-[dichloro(propan-2-yl)silyl]ethanamine
CID 87336074
N-[chloro(propan-2-yl)silyl]ethanamine
CID 123320313
N-[chloro(propyl)silyl]ethanamine
CID 123554072
N-[dichloro(methyl)silyl]propan-2-amine
CID 140818449
3-[Dichloro(propyl)silyl]propan-1-amine
CID 141250415

Frequently Asked Questions

What is the IUPAC name of 1-dichlorosilylbutan-2-amine?
The IUPAC name of 1-dichlorosilylbutan-2-amine (CID 173003363) is 1-dichlorosilylbutan-2-amine.
What is the SMILES notation for 1-dichlorosilylbutan-2-amine?
The canonical SMILES for 1-dichlorosilylbutan-2-amine is CCC(N)C[SiH](Cl)Cl.
What is the InChIKey of 1-dichlorosilylbutan-2-amine?
The InChIKey is NUWSKWWKEOAQSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11Cl2NSi/c1-2-4(7)3-8(5)6/h4,8H,2-3,7H2,1H3.
What are the key properties of 1-dichlorosilylbutan-2-amine?
1-dichlorosilylbutan-2-amine has a molecular weight of 172.13 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dichlorosilylbutan-2-amine is sourced from PubChem (CID 173003363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).