N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine

C7H10F7N — CID 150635872

IUPACN-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine
SMILESCCNCCC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7H10F7N/c1-2-15-4-3-5(8,9)6(10,11)7(12,13)14/h15H,2-4H2,1H3
InChIKeyUDUWWKHINAPLFW-UHFFFAOYSA-N
MW241.15 g/mol
LogP2.82
Rot. Bonds5

About N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine

N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine (PubChem CID 150635872) has the molecular formula C7H10F7N and a molecular weight of 241.15 g/mol. Its IUPAC name is N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine.

Molecular Properties

Compound NameN-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine
PubChem CID150635872
Molecular FormulaC7H10F7N
Molecular Weight241.15 g/mol
Exact Mass241.07
IUPAC NameN-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine
SMILESCCNCCC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C7H10F7N/c1-2-15-4-3-5(8,9)6(10,11)7(12,13)14/h15H,2-4H2,1H3
InChIKeyUDUWWKHINAPLFW-UHFFFAOYSA-N
XLogP2.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.15
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-(ethylamino)-1,1,1-trifluoro-2-methylbutan-2-ol
CID 80559493
N-(3,3,4,4,5,5,5-heptafluoropentyl)-2-methylbutanamide
CID 21049854
bis(N-ethylethanamine);3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl dihydrogen phosphate
CID 118123548
1,1,1,2,2,3,3-heptafluoroicosane
CID 98452405
N-ethyl-N',N'-dimethylethane-1,2-diamine;1,1,1-trifluoroethane
CID 143427394
N-ethyl-3,3,4,4-tetramethylpentan-1-amine
CID 81022340
N-ethyl-4,4,5,5,6,6,7,7,7-nonafluoro-2-(2,2,3,3,4,4,5,5,5-nonafluoropentyl)heptan-1-amine
CID 118123637
1,1,1,2,2,3,3,4,4-nonafluorooctane
CID 22002951
6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptadecafluoro-N-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptadecafluorotridecyl)tridecan-1-amine
CID 10533986
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-henicosafluorotetradecane
CID 22002799
N,N'-ditert-butyl-1,1,2,2,3,3-hexafluoropentane-1,5-diamine
CID 177295871
N,3-diethyl-3-methylhexan-1-amine
CID 163633802

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine?
The IUPAC name of N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine (CID 150635872) is N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine.
What is the SMILES notation for N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine?
The canonical SMILES for N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine is CCNCCC(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine?
The InChIKey is UDUWWKHINAPLFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F7N/c1-2-15-4-3-5(8,9)6(10,11)7(12,13)14/h15H,2-4H2,1H3.
What are the key properties of N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine?
N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine has a molecular weight of 241.15 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,3,4,4,5,5,5-heptafluoropentan-1-amine is sourced from PubChem (CID 150635872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).