1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine

C8H9F10N — CID 19761920

IUPAC1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine
SMILESCN(C)C(F)(F)C(C)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C8H9F10N/c1-4(9,8(17,18)19(2)3)5(10,11)6(12,13)7(14,15)16/h1-3H3
InChIKeySIBNLQIUSPQBRK-UHFFFAOYSA-N
MW309.15 g/mol
LogP3.70
Rot. Bonds4

About 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine

1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine (PubChem CID 19761920) has the molecular formula C8H9F10N and a molecular weight of 309.15 g/mol. Its IUPAC name is 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine.

Molecular Properties

Compound Name1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine
PubChem CID19761920
Molecular FormulaC8H9F10N
Molecular Weight309.15 g/mol
Exact Mass309.06
IUPAC Name1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine
SMILESCN(C)C(F)(F)C(C)(F)C(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C8H9F10N/c1-4(9,8(17,18)19(2)3)5(10,11)6(12,13)7(14,15)16/h1-3H3
InChIKeySIBNLQIUSPQBRK-UHFFFAOYSA-N
XLogP3.70
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.15
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1,2,2,3,3,3-heptafluoro-N,N-dimethylpropan-1-amine
CID 170273224
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CID 90441308
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-nonadecafluorodecane
CID 22600357
1,1,1,2,2,3,3,5,5,5-decafluoro-4-methyl-4-(trifluoromethyl)pentane
CID 11515508
1,1,1,2,2,3-hexafluoro-3,4,4-trimethylpentane
CID 22568684
1,1,1,2,2,3,3,4,4-nonafluoro-5,5-dimethylhexane
CID 129191399
CID 175811708
CID 175811708
1,1,1,2,2,3,3,4,4,4-decafluorobutane;hydrofluoride
CID 175814235
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-hexadecafluoroheptane;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane
CID 22712913
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,21-tetratetracontafluorohenicosane
CID 141072652
1,1,2,2,3,3,4,4,4-nonafluoro-N,N-bis(1,1,2,2,3,3,3-heptafluoropropyl)butan-1-amine
CID 19898566
4-chloro-1,1,1,2,2,3,3-heptafluoro-4-methylpentane
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Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine?
The IUPAC name of 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine (CID 19761920) is 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine.
What is the SMILES notation for 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine?
The canonical SMILES for 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine is CN(C)C(F)(F)C(C)(F)C(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine?
The InChIKey is SIBNLQIUSPQBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F10N/c1-4(9,8(17,18)19(2)3)5(10,11)6(12,13)7(14,15)16/h1-3H3.
What are the key properties of 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine?
1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine has a molecular weight of 309.15 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,3,4,4,5,5,5-decafluoro-N,N,2-trimethylpentan-1-amine is sourced from PubChem (CID 19761920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).