CID 170637664

C11H25N3O2Si — CID 170637664

IUPAC—
SMILESCCOC(OCC)[Si]CCCN/C(=N/C)NC
InChIInChI=1S/C11H25N3O2Si/c1-5-15-11(16-6-2)17-9-7-8-14-10(12-3)13-4/h11H,5-9H2,1-4H3,(H2,12,13,14)
InChIKeyLJVQGSKGZUJTSD-UHFFFAOYSA-N
MW259.43 g/mol
LogP0.65
Rot. Bonds9

About CID 170637664

CID 170637664 (PubChem CID 170637664) has the molecular formula C11H25N3O2Si and a molecular weight of 259.43 g/mol.

Molecular Properties

Compound NameCID 170637664
PubChem CID170637664
Molecular FormulaC11H25N3O2Si
Molecular Weight259.43 g/mol
Exact Mass259.17
IUPAC Name—
SMILESCCOC(OCC)[Si]CCCN/C(=N/C)NC
InChIInChI=1S/C11H25N3O2Si/c1-5-15-11(16-6-2)17-9-7-8-14-10(12-3)13-4/h11H,5-9H2,1-4H3,(H2,12,13,14)
InChIKeyLJVQGSKGZUJTSD-UHFFFAOYSA-N
XLogP0.65
TPSA54.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.43
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-(3,3-diethoxypropyl)-2,3-dimethylguanidine
CID 100673098
CID 168908388
CID 168908388
1-(3-butoxypropyl)-2,3-dimethylguanidine
CID 110914191
mercaptopropyldiethoxymethylsilane
CID 53425327
1,2-dimethyl-3-(3-methylsulfanylpropyl)guanidine
CID 102135691
1-[4-(diethylamino)butyl]-2,3-dimethylguanidine
CID 110917279
1-(2-hydroxyethyl)-2,3-dimethylguanidine
CID 22977239
5-[(N,N'-dimethylcarbamimidoyl)amino]-N-methylpentanamide
CID 170258094
[1-butoxy-5-[(N,N'-dimethylcarbamimidoyl)amino]-1-oxopentan-2-yl]azanium
CID 58636345
1-[7-(dimethylamino)heptyl]-2,3-dimethylguanidine;hydroiodide
CID 110918889
1-[3-[ethylsulfonyl(methyl)amino]propyl]-2,3-dimethylguanidine
CID 75462498
1-(4-ethoxybutyl)-3-(3-ethoxypropyl)-2-methylguanidine
CID 111222873

Frequently Asked Questions

What is the IUPAC name of CID 170637664?
The IUPAC name of CID 170637664 (CID 170637664) is not available.
What is the SMILES notation for CID 170637664?
The canonical SMILES for CID 170637664 is CCOC(OCC)[Si]CCCN/C(=N/C)NC.
What is the InChIKey of CID 170637664?
The InChIKey is LJVQGSKGZUJTSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2Si/c1-5-15-11(16-6-2)17-9-7-8-14-10(12-3)13-4/h11H,5-9H2,1-4H3,(H2,12,13,14).
What are the key properties of CID 170637664?
CID 170637664 has a molecular weight of 259.43 g/mol, XLogP of 0.65, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170637664 is sourced from PubChem (CID 170637664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).