N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine

C7H19NOSi — CID 23126648

IUPACN-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine
SMILESCCCCNC[Si](C)(C)O
InChIInChI=1S/C7H19NOSi/c1-4-5-6-8-7-10(2,3)9/h8-9H,4-7H2,1-3H3
InChIKeyQXBMOPWVVMYTHT-UHFFFAOYSA-N
MW161.32 g/mol
LogP1.11
Rot. Bonds5

About N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine

N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine (PubChem CID 23126648) has the molecular formula C7H19NOSi and a molecular weight of 161.32 g/mol. Its IUPAC name is N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine.

Molecular Properties

Compound NameN-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine
PubChem CID23126648
Molecular FormulaC7H19NOSi
Molecular Weight161.32 g/mol
Exact Mass161.12
IUPAC NameN-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine
SMILESCCCCNC[Si](C)(C)O
InChIInChI=1S/C7H19NOSi/c1-4-5-6-8-7-10(2,3)9/h8-9H,4-7H2,1-3H3
InChIKeyQXBMOPWVVMYTHT-UHFFFAOYSA-N
XLogP1.11
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.32
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine?
The IUPAC name of N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine (CID 23126648) is N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine.
What is the SMILES notation for N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine?
The canonical SMILES for N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine is CCCCNC[Si](C)(C)O.
What is the InChIKey of N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine?
The InChIKey is QXBMOPWVVMYTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19NOSi/c1-4-5-6-8-7-10(2,3)9/h8-9H,4-7H2,1-3H3.
What are the key properties of N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine?
N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine has a molecular weight of 161.32 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[hydroxy(dimethyl)silyl]methyl]butan-1-amine is sourced from PubChem (CID 23126648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).