N,N-diphenyl-2-silyloxan-2-amine;iron

C17H21FeNOSi — CID 173315730

IUPACN,N-diphenyl-2-silyloxan-2-amine;iron
SMILES[Fe].[SiH3]C1(N(c2ccccc2)c2ccccc2)CCCCO1
InChIInChI=1S/C17H21NOSi.Fe/c20-17(13-7-8-14-19-17)18(15-9-3-1-4-10-15)16-11-5-2-6-12-16;/h1-6,9-12H,7-8,13-14H2,20H3;
InChIKeyLNXMJZAHEHWAOR-UHFFFAOYSA-N
MW339.29 g/mol
LogP3.04
Rot. Bonds3

About N,N-diphenyl-2-silyloxan-2-amine;iron

N,N-diphenyl-2-silyloxan-2-amine;iron (PubChem CID 173315730) has the molecular formula C17H21FeNOSi and a molecular weight of 339.29 g/mol. Its IUPAC name is N,N-diphenyl-2-silyloxan-2-amine;iron.

Molecular Properties

Compound NameN,N-diphenyl-2-silyloxan-2-amine;iron
PubChem CID173315730
Molecular FormulaC17H21FeNOSi
Molecular Weight339.29 g/mol
Exact Mass339.07
IUPAC NameN,N-diphenyl-2-silyloxan-2-amine;iron
SMILES[Fe].[SiH3]C1(N(c2ccccc2)c2ccccc2)CCCCO1
InChIInChI=1S/C17H21NOSi.Fe/c20-17(13-7-8-14-19-17)18(15-9-3-1-4-10-15)16-11-5-2-6-12-16;/h1-6,9-12H,7-8,13-14H2,20H3;
InChIKeyLNXMJZAHEHWAOR-UHFFFAOYSA-N
XLogP3.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.29
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 N,N-diphenyl-2-silyloxan-2-amine;iron?
The IUPAC name of N,N-diphenyl-2-silyloxan-2-amine;iron (CID 173315730) is N,N-diphenyl-2-silyloxan-2-amine;iron.
What is the SMILES notation for N,N-diphenyl-2-silyloxan-2-amine;iron?
The canonical SMILES for N,N-diphenyl-2-silyloxan-2-amine;iron is [Fe].[SiH3]C1(N(c2ccccc2)c2ccccc2)CCCCO1.
What is the InChIKey of N,N-diphenyl-2-silyloxan-2-amine;iron?
The InChIKey is LNXMJZAHEHWAOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NOSi.Fe/c20-17(13-7-8-14-19-17)18(15-9-3-1-4-10-15)16-11-5-2-6-12-16;/h1-6,9-12H,7-8,13-14H2,20H3;.
What are the key properties of N,N-diphenyl-2-silyloxan-2-amine;iron?
N,N-diphenyl-2-silyloxan-2-amine;iron has a molecular weight of 339.29 g/mol, XLogP of 3.04, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-2-silyloxan-2-amine;iron is sourced from PubChem (CID 173315730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).