N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine

C14H22F3N — CID 123265710

IUPACN,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine
SMILESCC=C(C)C(=CC(=CCCC)C(F)(F)F)N(C)C
InChIInChI=1S/C14H22F3N/c1-6-8-9-12(14(15,16)17)10-13(18(4)5)11(3)7-2/h7,9-10H,6,8H2,1-5H3
InChIKeyAWLSYBDCDZFIPI-UHFFFAOYSA-N
MW261.33 g/mol
LogP4.69
Rot. Bonds5

About N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine

N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine (PubChem CID 123265710) has the molecular formula C14H22F3N and a molecular weight of 261.33 g/mol. Its IUPAC name is N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine.

Molecular Properties

Compound NameN,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine
PubChem CID123265710
Molecular FormulaC14H22F3N
Molecular Weight261.33 g/mol
Exact Mass261.17
IUPAC NameN,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine
SMILESCC=C(C)C(=CC(=CCCC)C(F)(F)F)N(C)C
InChIInChI=1S/C14H22F3N/c1-6-8-9-12(14(15,16)17)10-13(18(4)5)11(3)7-2/h7,9-10H,6,8H2,1-5H3
InChIKeyAWLSYBDCDZFIPI-UHFFFAOYSA-N
XLogP4.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine?
The IUPAC name of N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine (CID 123265710) is N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine.
What is the SMILES notation for N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine?
The canonical SMILES for N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine is CC=C(C)C(=CC(=CCCC)C(F)(F)F)N(C)C.
What is the InChIKey of N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine?
The InChIKey is AWLSYBDCDZFIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22F3N/c1-6-8-9-12(14(15,16)17)10-13(18(4)5)11(3)7-2/h7,9-10H,6,8H2,1-5H3.
What are the key properties of N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine?
N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine has a molecular weight of 261.33 g/mol, XLogP of 4.69, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-6-(trifluoromethyl)deca-2,4,6-trien-4-amine is sourced from PubChem (CID 123265710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).