1-(amino-chloro-propylsilyl)propane

C6H16ClNSi — CID 87995933

IUPAC1-(amino-chloro-propylsilyl)propane
SMILESCCC[Si](N)(Cl)CCC
InChIInChI=1S/C6H16ClNSi/c1-3-5-9(7,8)6-4-2/h3-6,8H2,1-2H3
InChIKeyQLHZMENREHGLKE-UHFFFAOYSA-N
MW165.74 g/mol
LogP2.45
Rot. Bonds4

About 1-(amino-chloro-propylsilyl)propane

1-(amino-chloro-propylsilyl)propane (PubChem CID 87995933) has the molecular formula C6H16ClNSi and a molecular weight of 165.74 g/mol. Its IUPAC name is 1-(amino-chloro-propylsilyl)propane.

Molecular Properties

Compound Name1-(amino-chloro-propylsilyl)propane
PubChem CID87995933
Molecular FormulaC6H16ClNSi
Molecular Weight165.74 g/mol
Exact Mass165.07
IUPAC Name1-(amino-chloro-propylsilyl)propane
SMILESCCC[Si](N)(Cl)CCC
InChIInChI=1S/C6H16ClNSi/c1-3-5-9(7,8)6-4-2/h3-6,8H2,1-2H3
InChIKeyQLHZMENREHGLKE-UHFFFAOYSA-N
XLogP2.45
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.74
LogP ≤ 52.45
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

chloro-difluoro-propylsilane
CID 14619523
dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane
CID 87144873
tert-butyl-chloro-dipropylsilane
CID 14465427
chloro-tri(nonyl)silane
CID 140826961
chloro-hex-5-enyl-oct-7-enyl-propylsilane
CID 151435070
dichloro-[6-[dichloro-[6-[dichloro-[6-[dichloro-[6-[dichloro(heptyl)silyl]hexyl]silyl]hexyl]silyl]hexyl]silyl]hexyl]-propylsilane
CID 59426953
chloro-ethoxy-methyl-propylsilane
CID 141340520
N-(tert-butyl-chloro-propylsilyl)methanamine
CID 87335184
butane;hydrazine
CID 161056989
tripropylsilylphosphane
CID 175246574
triethyl(propyl)silane
CID 523674
chloro-phenyl-dipropylsilane
CID 57124380

Frequently Asked Questions

What is the IUPAC name of 1-(amino-chloro-propylsilyl)propane?
The IUPAC name of 1-(amino-chloro-propylsilyl)propane (CID 87995933) is 1-(amino-chloro-propylsilyl)propane.
What is the SMILES notation for 1-(amino-chloro-propylsilyl)propane?
The canonical SMILES for 1-(amino-chloro-propylsilyl)propane is CCC[Si](N)(Cl)CCC.
What is the InChIKey of 1-(amino-chloro-propylsilyl)propane?
The InChIKey is QLHZMENREHGLKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16ClNSi/c1-3-5-9(7,8)6-4-2/h3-6,8H2,1-2H3.
What are the key properties of 1-(amino-chloro-propylsilyl)propane?
1-(amino-chloro-propylsilyl)propane has a molecular weight of 165.74 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(amino-chloro-propylsilyl)propane is sourced from PubChem (CID 87995933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).