(Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine

C7H10F3N — CID 162593872

IUPAC(Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine
SMILESC=C(/C=C\N)C(C)C(F)(F)F
InChIInChI=1S/C7H10F3N/c1-5(3-4-11)6(2)7(8,9)10/h3-4,6H,1,11H2,2H3/b4-3-
InChIKeyYREOLLZVJBKJBN-ARJAWSKDSA-N
MW165.16 g/mol
LogP2.21
Rot. Bonds2

About (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine

(Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine (PubChem CID 162593872) has the molecular formula C7H10F3N and a molecular weight of 165.16 g/mol. Its IUPAC name is (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine.

Molecular Properties

Compound Name(Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine
PubChem CID162593872
Molecular FormulaC7H10F3N
Molecular Weight165.16 g/mol
Exact Mass165.08
IUPAC Name(Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine
SMILESC=C(/C=C\N)C(C)C(F)(F)F
InChIInChI=1S/C7H10F3N/c1-5(3-4-11)6(2)7(8,9)10/h3-4,6H,1,11H2,2H3/b4-3-
InChIKeyYREOLLZVJBKJBN-ARJAWSKDSA-N
XLogP2.21
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.16
LogP ≤ 52.21
H-Bond Donors ≤ 51
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 (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine?
The IUPAC name of (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine (CID 162593872) is (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine.
What is the SMILES notation for (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine?
The canonical SMILES for (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine is C=C(/C=C\N)C(C)C(F)(F)F.
What is the InChIKey of (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine?
The InChIKey is YREOLLZVJBKJBN-ARJAWSKDSA-N. The full InChI is InChI=1S/C7H10F3N/c1-5(3-4-11)6(2)7(8,9)10/h3-4,6H,1,11H2,2H3/b4-3-.
What are the key properties of (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine?
(Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine has a molecular weight of 165.16 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5,5,5-trifluoro-4-methyl-3-methylidenepent-1-en-1-amine is sourced from PubChem (CID 162593872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).