N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine

C5H10F7N3Si — CID 151582040

IUPACN-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine
SMILESCC[Si](N)(N)NC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C5H10F7N3Si/c1-2-16(13,14)15-5(11,12)3(6,7)4(8,9)10/h15H,2,13-14H2,1H3
InChIKeyQGRWGKBYXXURDP-UHFFFAOYSA-N
MW273.23 g/mol
LogP1.24
Rot. Bonds4

About N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine

N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine (PubChem CID 151582040) has the molecular formula C5H10F7N3Si and a molecular weight of 273.23 g/mol. Its IUPAC name is N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine.

Molecular Properties

Compound NameN-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine
PubChem CID151582040
Molecular FormulaC5H10F7N3Si
Molecular Weight273.23 g/mol
Exact Mass273.05
IUPAC NameN-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine
SMILESCC[Si](N)(N)NC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C5H10F7N3Si/c1-2-16(13,14)15-5(11,12)3(6,7)4(8,9)10/h15H,2,13-14H2,1H3
InChIKeyQGRWGKBYXXURDP-UHFFFAOYSA-N
XLogP1.24
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.23
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

ethanol;1,1,2,2,3,3,4,4,4-nonafluorobutan-1-amine
CID 175042472
ethyl-fluoro-bis(1,1,2,2,3,3,3-heptafluoropropyl)silane
CID 158035981
triethyl(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-pentacosafluorododecyl)silane
CID 175552208
N-ethyl-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctan-1-amine
CID 87370892
ethanol;1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-henicosafluorodecan-1-amine
CID 175197011
ethyl-dimethyl-(trifluoromethyl)silane
CID 90447698
1,1,2,2,3,3-hexafluoro-N'-methylpropane-1,3-diamine
CID 87847871
1,1,1,2,2,3,3,4,4,4-decafluorobutane;N,N-diethylethanamine
CID 174739856
1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluoro-N-(1,1,2,2,3,3,3-heptafluoropropyl)hexan-1-amine
CID 90982918
1,1,1,2,2,3,3,4,4-nonafluoro-4-triaminosilylbutane
CID 139751434
1,1,2,2,2-pentafluoro-N-methylethanamine
CID 23236127
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,19-octatriacontafluoro-10-propyl-N-silylnonadecan-10-amine
CID 123387003

Frequently Asked Questions

What is the IUPAC name of N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine?
The IUPAC name of N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine (CID 151582040) is N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine.
What is the SMILES notation for N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine?
The canonical SMILES for N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine is CC[Si](N)(N)NC(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine?
The InChIKey is QGRWGKBYXXURDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F7N3Si/c1-2-16(13,14)15-5(11,12)3(6,7)4(8,9)10/h15H,2,13-14H2,1H3.
What are the key properties of N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine?
N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine has a molecular weight of 273.23 g/mol, XLogP of 1.24, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[diamino(ethyl)silyl]-1,1,2,2,3,3,3-heptafluoropropan-1-amine is sourced from PubChem (CID 151582040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).