2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine

C18H24FNOSi — CID 122224024

IUPAC2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine
SMILESCN(CC[Si]1(c2ccc(F)cc2)CCCC1)Cc1ccco1
InChIInChI=1S/C18H24FNOSi/c1-20(15-17-5-4-11-21-17)10-14-22(12-2-3-13-22)18-8-6-16(19)7-9-18/h4-9,11H,2-3,10,12-15H2,1H3
InChIKeyMFVNOAOSTPXKAO-UHFFFAOYSA-N
MW317.48 g/mol
LogP4.00
Rot. Bonds6

About 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine

2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine (PubChem CID 122224024) has the molecular formula C18H24FNOSi and a molecular weight of 317.48 g/mol. Its IUPAC name is 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine.

Molecular Properties

Compound Name2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine
PubChem CID122224024
Molecular FormulaC18H24FNOSi
Molecular Weight317.48 g/mol
Exact Mass317.16
IUPAC Name2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine
SMILESCN(CC[Si]1(c2ccc(F)cc2)CCCC1)Cc1ccco1
InChIInChI=1S/C18H24FNOSi/c1-20(15-17-5-4-11-21-17)10-14-22(12-2-3-13-22)18-8-6-16(19)7-9-18/h4-9,11H,2-3,10,12-15H2,1H3
InChIKeyMFVNOAOSTPXKAO-UHFFFAOYSA-N
XLogP4.00
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.48
LogP ≤ 54.00
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

1-(furan-2-yl)-N-(furan-2-ylmethyl)-N-methylmethanamine;hydrochloride
CID 3028206
N-(furan-2-ylmethyl)-N-methyl-3-pyrrolidin-2-ylpropan-1-amine
CID 62479770
N'-(furan-2-ylmethyl)-N'-methyl-N-propan-2-ylethane-1,2-diamine
CID 60843082
9-bromo-N-(furan-2-ylmethyl)-N-methylnonan-1-amine
CID 105343610
4-fluoro-2-[[furan-2-ylmethyl(methyl)amino]methyl]aniline
CID 43526553
4-[furan-2-ylmethyl(methyl)amino]butan-1-ol
CID 43527145
4-fluoro-2-[[furan-2-ylmethyl(methyl)amino]methyl]benzoic acid
CID 114014604
4-[furan-2-ylmethyl(methyl)amino]butanenitrile
CID 43396926
N-cyclopentyl-4-fluoro-N-(furan-2-ylmethyl)benzamide
CID 60737869
1-(2-chlorophenyl)-3-[furan-2-ylmethyl(methyl)amino]propan-1-one
CID 55099156
4-[furan-2-ylmethyl(methyl)amino]-1-phenylbutan-1-one
CID 60695002
1-(3-bromo-4-fluorophenyl)-N-(furan-2-ylmethyl)-N-methylmethanamine
CID 61036810

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine?
The IUPAC name of 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine (CID 122224024) is 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine.
What is the SMILES notation for 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine?
The canonical SMILES for 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine is CN(CC[Si]1(c2ccc(F)cc2)CCCC1)Cc1ccco1.
What is the InChIKey of 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine?
The InChIKey is MFVNOAOSTPXKAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FNOSi/c1-20(15-17-5-4-11-21-17)10-14-22(12-2-3-13-22)18-8-6-16(19)7-9-18/h4-9,11H,2-3,10,12-15H2,1H3.
What are the key properties of 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine?
2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine has a molecular weight of 317.48 g/mol, XLogP of 4.00, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-fluorophenyl)silolan-1-yl]-N-(furan-2-ylmethyl)-N-methylethanamine is sourced from PubChem (CID 122224024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).