CID 174773440

C14H17NO2Si+ — CID 174773440

IUPAC—
SMILESCc1cccc(/N=C/c2ccco2)c1O[Si](C)C.[H+]
InChIInChI=1S/C14H16NO2Si/c1-11-6-4-8-13(14(11)17-18(2)3)15-10-12-7-5-9-16-12/h4-10H,1-3H3/p+1/b15-10+
InChIKeyIDWKEBKVTPXLOQ-XNTDXEJSSA-O
MW259.38 g/mol
LogP4.08
Rot. Bonds4

About CID 174773440

CID 174773440 (PubChem CID 174773440) has the molecular formula C14H17NO2Si+ and a molecular weight of 259.38 g/mol.

Molecular Properties

Compound NameCID 174773440
PubChem CID174773440
Molecular FormulaC14H17NO2Si+
Molecular Weight259.38 g/mol
Exact Mass259.10
IUPAC Name—
SMILESCc1cccc(/N=C/c2ccco2)c1O[Si](C)C.[H+]
InChIInChI=1S/C14H16NO2Si/c1-11-6-4-8-13(14(11)17-18(2)3)15-10-12-7-5-9-16-12/h4-10H,1-3H3/p+1/b15-10+
InChIKeyIDWKEBKVTPXLOQ-XNTDXEJSSA-O
XLogP4.08
TPSA34.73 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-(furan-2-yl)-N-[2-(furan-2-ylmethylideneamino)phenyl]methanimine
CID 10015655
CID 90458659
CID 90458659
N-(3,4-dimethylphenyl)-1-(furan-2-yl)methanimine
CID 961444
(E)-1-(furan-2-yl)-N-(6-methyl-2-pyridinyl)methanimine
CID 13285530
ethane;1-(furan-2-yl)-N-phenylmethanimine
CID 160534475
(E)-N-bis(2,6-dimethylphenyl)phosphoryl-1-(furan-2-yl)methanimine
CID 44521537
N-[2,6-di(propan-2-yl)phenyl]-1-(furan-2-yl)methanimine
CID 850160
(E)-1-(furan-2-yl)-N-trimethylsilylmethanimine
CID 10630921
1-(furan-2-yl)-N-(4-methyl-2-pyridinyl)methanimine
CID 11206226
1-(furan-2-yl)-N-oxidomethanimine
CID 135527449
1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine
CID 13128411
1-(furan-2-yl)-N-hydroperoxymethanimine
CID 131862046

Frequently Asked Questions

What is the IUPAC name of CID 174773440?
The IUPAC name of CID 174773440 (CID 174773440) is not available.
What is the SMILES notation for CID 174773440?
The canonical SMILES for CID 174773440 is Cc1cccc(/N=C/c2ccco2)c1O[Si](C)C.[H+].
What is the InChIKey of CID 174773440?
The InChIKey is IDWKEBKVTPXLOQ-XNTDXEJSSA-O. The full InChI is InChI=1S/C14H16NO2Si/c1-11-6-4-8-13(14(11)17-18(2)3)15-10-12-7-5-9-16-12/h4-10H,1-3H3/p+1/b15-10+.
What are the key properties of CID 174773440?
CID 174773440 has a molecular weight of 259.38 g/mol, XLogP of 4.08, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174773440 is sourced from PubChem (CID 174773440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).