CID 68827824

C13H13NOSi — CID 68827824

IUPAC—
SMILESCO[Si]N(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H13NOSi/c1-15-16-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3
InChIKeyVUELXQLWLBTLPX-UHFFFAOYSA-N
MW227.34 g/mol
LogP3.01
Rot. Bonds4

About CID 68827824

CID 68827824 (PubChem CID 68827824) has the molecular formula C13H13NOSi and a molecular weight of 227.34 g/mol.

Molecular Properties

Compound NameCID 68827824
PubChem CID68827824
Molecular FormulaC13H13NOSi
Molecular Weight227.34 g/mol
Exact Mass227.08
IUPAC Name—
SMILESCO[Si]N(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H13NOSi/c1-15-16-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3
InChIKeyVUELXQLWLBTLPX-UHFFFAOYSA-N
XLogP3.01
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.34
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;bis(N-methyl-N-phenylaniline)
CID 160716887
1-N,4-N-bis[4-(4-methoxy-N-(4-methoxyphenyl)anilino)phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine
CID 132507926
N-iodo-N-methoxyaniline
CID 142027982
ethene;N-methyl-N-phenylaniline
CID 144541479
N,N-dimethylaniline
CID 70392672
4-[4-[N-(4-methoxyphenyl)-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline
CID 90228188
4-[4-(N-(4-methoxyphenyl)anilino)phenyl]-N-[4-[4-(N-(4-methoxyphenyl)anilino)phenyl]phenyl]-N-phenylaniline
CID 90228198
6-N,16-N-bis(4-methoxyphenyl)-6-N,16-N-diphenylpentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaene-6,16-diamine
CID 166032295
anisole;trihydrofluoride
CID 174796385
ethane;1-N,1-N,4-N,4-N-tetraphenylbenzene-1,4-diamine
CID 91310242
CID 172685187
CID 172685187
N,N-dimethylaniline;hydrofluoride
CID 160775229

Frequently Asked Questions

What is the IUPAC name of CID 68827824?
The IUPAC name of CID 68827824 (CID 68827824) is not available.
What is the SMILES notation for CID 68827824?
The canonical SMILES for CID 68827824 is CO[Si]N(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 68827824?
The InChIKey is VUELXQLWLBTLPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NOSi/c1-15-16-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3.
What are the key properties of CID 68827824?
CID 68827824 has a molecular weight of 227.34 g/mol, XLogP of 3.01, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 68827824 is sourced from PubChem (CID 68827824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).