2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine

C16H23F11N2O — CID 159783187

IUPAC2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine
SMILESFC(F)(F)CC(F)(F)CCC(F)(F)C(F)(F)CC(F)(F)CNCCN1CCOCC1
InChIInChI=1S/C16H23F11N2O/c17-12(18,10-16(25,26)27)1-2-14(21,22)15(23,24)9-13(19,20)11-28-3-4-29-5-7-30-8-6-29/h28H,1-11H2
InChIKeyQPPHJXNDPXZFSC-UHFFFAOYSA-N
MW468.35 g/mol
LogP4.57
Rot. Bonds12

About 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine

2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine (PubChem CID 159783187) has the molecular formula C16H23F11N2O and a molecular weight of 468.35 g/mol. Its IUPAC name is 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine.

Molecular Properties

Compound Name2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine
PubChem CID159783187
Molecular FormulaC16H23F11N2O
Molecular Weight468.35 g/mol
Exact Mass468.16
IUPAC Name2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine
SMILESFC(F)(F)CC(F)(F)CCC(F)(F)C(F)(F)CC(F)(F)CNCCN1CCOCC1
InChIInChI=1S/C16H23F11N2O/c17-12(18,10-16(25,26)27)1-2-14(21,22)15(23,24)9-13(19,20)11-28-3-4-29-5-7-30-8-6-29/h28H,1-11H2
InChIKeyQPPHJXNDPXZFSC-UHFFFAOYSA-N
XLogP4.57
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.35
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine with MolForge

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Related Compounds

4,4,4-trifluoro-N-(2-morpholin-4-ylethyl)butan-1-amine
CID 115513486
CID 59303713
CID 59303713
2,2,3,3,4,4,5,5,7,7,7-undecafluoro-N-(2-morpholin-4-ylethyl)heptanamide
CID 58855436
2-morpholin-4-yl-N-(trifluoromethylsulfanyl)ethanamine
CID 138480646
4,4,6,6,7,7,7-heptafluoro-1-morpholin-4-ylheptan-2-ol
CID 58855373
1-(2-morpholin-4-ylethylamino)propan-2-ol
CID 43393555
2-(2-morpholin-4-ylethylamino)acetonitrile
CID 28583059
2,2,3,3,4,4,5,5,7,7,8,8,9,9,10,10,10-heptadecafluoro-N-(2-morpholin-4-ylethyl)decanamide
CID 58855463
2-morpholin-4-yl-N-[[3-(trifluoromethyl)-2-pyridinyl]methyl]ethanamine
CID 121378982
N-[2-[(2-methylpropan-2-yl)oxy]ethyl]-2-morpholin-4-ylethanamine
CID 112588697
1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one
CID 109015660
2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol
CID 60886953

Frequently Asked Questions

What is the IUPAC name of 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine?
The IUPAC name of 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine (CID 159783187) is 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine.
What is the SMILES notation for 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine?
The canonical SMILES for 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine is FC(F)(F)CC(F)(F)CCC(F)(F)C(F)(F)CC(F)(F)CNCCN1CCOCC1.
What is the InChIKey of 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine?
The InChIKey is QPPHJXNDPXZFSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23F11N2O/c17-12(18,10-16(25,26)27)1-2-14(21,22)15(23,24)9-13(19,20)11-28-3-4-29-5-7-30-8-6-29/h28H,1-11H2.
What are the key properties of 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine?
2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine has a molecular weight of 468.35 g/mol, XLogP of 4.57, 12 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4,5,5,8,8,10,10,10-undecafluoro-N-(2-morpholin-4-ylethyl)decan-1-amine is sourced from PubChem (CID 159783187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).