1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine

C6H18N2OSi — CID 140533872

IUPAC1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine
SMILESCCC(N)[Si](C)(O)C(C)N
InChIInChI=1S/C6H18N2OSi/c1-4-6(8)10(3,9)5(2)7/h5-6,9H,4,7-8H2,1-3H3
InChIKeyMIWHQNXAHYFBEQ-UHFFFAOYSA-N
MW162.31 g/mol
LogP-0.28
Rot. Bonds3

About 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine

1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine (PubChem CID 140533872) has the molecular formula C6H18N2OSi and a molecular weight of 162.31 g/mol. Its IUPAC name is 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine.

Molecular Properties

Compound Name1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine
PubChem CID140533872
Molecular FormulaC6H18N2OSi
Molecular Weight162.31 g/mol
Exact Mass162.12
IUPAC Name1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine
SMILESCCC(N)[Si](C)(O)C(C)N
InChIInChI=1S/C6H18N2OSi/c1-4-6(8)10(3,9)5(2)7/h5-6,9H,4,7-8H2,1-3H3
InChIKeyMIWHQNXAHYFBEQ-UHFFFAOYSA-N
XLogP-0.28
TPSA72.27 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.31
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[1-aminoethyl(diethoxy)silyl]propan-1-amine
CID 174628727
1-[diethyl(methyl)silyl]propan-1-amine
CID 174630551
1-(1-aminopropyl-methyl-trimethylsilyloxysilyl)propan-1-amine
CID 23164306
hydroxy-dimethyl-(2-methylbutyl)silane
CID 57226261
hydroxylamine;2-methylbutane
CID 175063986
butan-2-amine;(2R)-butan-2-amine;methane
CID 160926504
4-methylhexane-2,3-diamine
CID 123983512
propan-2-amine;propane;propan-2-ol
CID 161404449
1-aminopropan-1-ol;hydrochloride
CID 18547293
CID 169430456
CID 169430456
(2S)-2-amino-3-methylpentanamide
CID 10290817
butan-2-yl-tert-butyl-hydroxy-methylsilane
CID 139986240

Frequently Asked Questions

What is the IUPAC name of 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine?
The IUPAC name of 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine (CID 140533872) is 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine.
What is the SMILES notation for 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine?
The canonical SMILES for 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine is CCC(N)[Si](C)(O)C(C)N.
What is the InChIKey of 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine?
The InChIKey is MIWHQNXAHYFBEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N2OSi/c1-4-6(8)10(3,9)5(2)7/h5-6,9H,4,7-8H2,1-3H3.
What are the key properties of 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine?
1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine has a molecular weight of 162.31 g/mol, XLogP of -0.28, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminoethyl-hydroxy-methylsilyl)propan-1-amine is sourced from PubChem (CID 140533872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).