CID 175355597

C12H36N6O2Si2 — CID 175355597

IUPAC—
SMILESCO[SiH](CCCCNC(C)N1CCNCC1)OC.N[SiH](N)N
InChIInChI=1S/C12H29N3O2Si.H7N3Si/c1-12(15-9-7-13-8-10-15)14-6-4-5-11-18(16-2)17-3;1-4(2)3/h12-14,18H,4-11H2,1-3H3;4H,1-3H2
InChIKeyUHHKNUZLQYRKPD-UHFFFAOYSA-N
MW352.63 g/mol
LogP-2.30
Rot. Bonds9

About CID 175355597

CID 175355597 (PubChem CID 175355597) has the molecular formula C12H36N6O2Si2 and a molecular weight of 352.63 g/mol.

Molecular Properties

Compound NameCID 175355597
PubChem CID175355597
Molecular FormulaC12H36N6O2Si2
Molecular Weight352.63 g/mol
Exact Mass352.24
IUPAC Name—
SMILESCO[SiH](CCCCNC(C)N1CCNCC1)OC.N[SiH](N)N
InChIInChI=1S/C12H29N3O2Si.H7N3Si/c1-12(15-9-7-13-8-10-15)14-6-4-5-11-18(16-2)17-3;1-4(2)3/h12-14,18H,4-11H2,1-3H3;4H,1-3H2
InChIKeyUHHKNUZLQYRKPD-UHFFFAOYSA-N
XLogP-2.30
TPSA123.82 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.63
LogP ≤ 5-2.30
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

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 CID 175355597?
The IUPAC name of CID 175355597 (CID 175355597) is not available.
What is the SMILES notation for CID 175355597?
The canonical SMILES for CID 175355597 is CO[SiH](CCCCNC(C)N1CCNCC1)OC.N[SiH](N)N.
What is the InChIKey of CID 175355597?
The InChIKey is UHHKNUZLQYRKPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29N3O2Si.H7N3Si/c1-12(15-9-7-13-8-10-15)14-6-4-5-11-18(16-2)17-3;1-4(2)3/h12-14,18H,4-11H2,1-3H3;4H,1-3H2.
What are the key properties of CID 175355597?
CID 175355597 has a molecular weight of 352.63 g/mol, XLogP of -2.30, 9 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175355597 is sourced from PubChem (CID 175355597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).