N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine

C12H20FNSi — CID 174248167

IUPACN-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine
SMILESCCC(CC)N([SiH3])Cc1ccc(F)cc1
InChIInChI=1S/C12H20FNSi/c1-3-12(4-2)14(15)9-10-5-7-11(13)8-6-10/h5-8,12H,3-4,9H2,1-2,15H3
InChIKeyBOAHRKCJTPKBDW-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.10
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine

N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine (PubChem CID 174248167) has the molecular formula C12H20FNSi and a molecular weight of 225.38 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine
PubChem CID174248167
Molecular FormulaC12H20FNSi
Molecular Weight225.38 g/mol
Exact Mass225.13
IUPAC NameN-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine
SMILESCCC(CC)N([SiH3])Cc1ccc(F)cc1
InChIInChI=1S/C12H20FNSi/c1-3-12(4-2)14(15)9-10-5-7-11(13)8-6-10/h5-8,12H,3-4,9H2,1-2,15H3
InChIKeyBOAHRKCJTPKBDW-UHFFFAOYSA-N
XLogP2.10
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-N-[(4-fluorophenyl)methyl]-2-N-methylbutane-1,2-diamine
CID 61413577
ethane;1-(4-fluorophenyl)-N,N-dimethylmethanamine
CID 163403663
2-N-[(4-fluorophenyl)methyl]-2-N,2-dimethylbutane-1,2-diamine
CID 61413159
2-[(4-fluorophenyl)methyl-methylamino]propan-1-ol
CID 112701198
N-[(4-fluorophenyl)methyl]-N-(1-hydroxybutan-2-yl)-4-oxopentanamide
CID 46994143
2-[[(4-fluorophenyl)methyl-methylamino]methyl]butanenitrile
CID 115253889
N-butyl-N-[(4-fluorophenyl)methyl]butan-1-amine
CID 6422133
N'-[(4-fluorophenyl)methyl]-N'-methylmethanediamine
CID 115225832
N-(bromomethyl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 115261999
1-N-butan-2-yl-2-N-[(4-fluorophenyl)methyl]-2-N-methylpropane-1,2-diamine
CID 62569275
2-N-[(4-fluorophenyl)methyl]-2-N-methyl-1-N-pentan-3-ylpropane-1,2-diamine
CID 62569276
(2S)-2-amino-N-cyclopropyl-N-[(4-fluorophenyl)methyl]butanamide
CID 79024748

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine?
The IUPAC name of N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine (CID 174248167) is N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine is CCC(CC)N([SiH3])Cc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine?
The InChIKey is BOAHRKCJTPKBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20FNSi/c1-3-12(4-2)14(15)9-10-5-7-11(13)8-6-10/h5-8,12H,3-4,9H2,1-2,15H3.
What are the key properties of N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine?
N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine has a molecular weight of 225.38 g/mol, XLogP of 2.10, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-N-silylpentan-3-amine is sourced from PubChem (CID 174248167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).