CID 149175285

C19H20BrNSi- — CID 149175285

IUPAC—
SMILESC[Si-](C)(C)Cn1c2c(c3cc(Br)ccc31)-c1ccccc1C2
InChIInChI=1S/C19H20BrNSi/c1-22(2,3)12-21-17-9-8-14(20)11-16(17)19-15-7-5-4-6-13(15)10-18(19)21/h4-9,11H,10,12H2,1-3H3/q-1
InChIKeyZRUDUXUSKSSHCX-UHFFFAOYSA-N
MW370.37 g/mol
LogP5.85
Rot. Bonds2

About CID 149175285

CID 149175285 (PubChem CID 149175285) has the molecular formula C19H20BrNSi- and a molecular weight of 370.37 g/mol.

Molecular Properties

Compound NameCID 149175285
PubChem CID149175285
Molecular FormulaC19H20BrNSi-
Molecular Weight370.37 g/mol
Exact Mass369.06
IUPAC Name—
SMILESC[Si-](C)(C)Cn1c2c(c3cc(Br)ccc31)-c1ccccc1C2
InChIInChI=1S/C19H20BrNSi/c1-22(2,3)12-21-17-9-8-14(20)11-16(17)19-15-7-5-4-6-13(15)10-18(19)21/h4-9,11H,10,12H2,1-3H3/q-1
InChIKeyZRUDUXUSKSSHCX-UHFFFAOYSA-N
XLogP5.85
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.37
LogP ≤ 55.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 149175285?
The IUPAC name of CID 149175285 (CID 149175285) is not available.
What is the SMILES notation for CID 149175285?
The canonical SMILES for CID 149175285 is C[Si-](C)(C)Cn1c2c(c3cc(Br)ccc31)-c1ccccc1C2.
What is the InChIKey of CID 149175285?
The InChIKey is ZRUDUXUSKSSHCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20BrNSi/c1-22(2,3)12-21-17-9-8-14(20)11-16(17)19-15-7-5-4-6-13(15)10-18(19)21/h4-9,11H,10,12H2,1-3H3/q-1.
What are the key properties of CID 149175285?
CID 149175285 has a molecular weight of 370.37 g/mol, XLogP of 5.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 149175285 is sourced from PubChem (CID 149175285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).