(Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine

C13H24FN — CID 146226342

IUPAC(Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine
SMILESC=C(/C(C)=C\N(C)CC(C)(C)C)C(C)F
InChIInChI=1S/C13H24FN/c1-10(11(2)12(3)14)8-15(7)9-13(4,5)6/h8,12H,2,9H2,1,3-7H3/b10-8-
InChIKeyFJHSJMYFSYEOCC-NTMALXAHSA-N
MW213.34 g/mol
LogP3.78
Rot. Bonds4

About (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine

(Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine (PubChem CID 146226342) has the molecular formula C13H24FN and a molecular weight of 213.34 g/mol. Its IUPAC name is (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine
PubChem CID146226342
Molecular FormulaC13H24FN
Molecular Weight213.34 g/mol
Exact Mass213.19
IUPAC Name(Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine
SMILESC=C(/C(C)=C\N(C)CC(C)(C)C)C(C)F
InChIInChI=1S/C13H24FN/c1-10(11(2)12(3)14)8-15(7)9-13(4,5)6/h8,12H,2,9H2,1,3-7H3/b10-8-
InChIKeyFJHSJMYFSYEOCC-NTMALXAHSA-N
XLogP3.78
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.34
LogP ≤ 53.78
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 (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine?
The IUPAC name of (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine (CID 146226342) is (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine.
What is the SMILES notation for (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine?
The canonical SMILES for (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine is C=C(/C(C)=C\N(C)CC(C)(C)C)C(C)F.
What is the InChIKey of (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine?
The InChIKey is FJHSJMYFSYEOCC-NTMALXAHSA-N. The full InChI is InChI=1S/C13H24FN/c1-10(11(2)12(3)14)8-15(7)9-13(4,5)6/h8,12H,2,9H2,1,3-7H3/b10-8-.
What are the key properties of (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine?
(Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine has a molecular weight of 213.34 g/mol, XLogP of 3.78, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(2,2-dimethylpropyl)-4-fluoro-N,2-dimethyl-3-methylidenepent-1-en-1-amine is sourced from PubChem (CID 146226342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).