(6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine

C15H26FNO — CID 142084753

IUPAC(6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine
SMILESC=C(F)/C=C\C(=C)C(C)(CCCN(C)C)OCC
InChIInChI=1S/C15H26FNO/c1-7-18-15(4,11-8-12-17(5)6)13(2)9-10-14(3)16/h9-10H,2-3,7-8,11-12H2,1,4-6H3/b10-9-
InChIKeyYUBSKKPTXVPLQQ-KTKRTIGZSA-N
MW255.38 g/mol
LogP3.72
Rot. Bonds9

About (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine

(6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine (PubChem CID 142084753) has the molecular formula C15H26FNO and a molecular weight of 255.38 g/mol. Its IUPAC name is (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine.

Molecular Properties

Compound Name(6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine
PubChem CID142084753
Molecular FormulaC15H26FNO
Molecular Weight255.38 g/mol
Exact Mass255.20
IUPAC Name(6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine
SMILESC=C(F)/C=C\C(=C)C(C)(CCCN(C)C)OCC
InChIInChI=1S/C15H26FNO/c1-7-18-15(4,11-8-12-17(5)6)13(2)9-10-14(3)16/h9-10H,2-3,7-8,11-12H2,1,4-6H3/b10-9-
InChIKeyYUBSKKPTXVPLQQ-KTKRTIGZSA-N
XLogP3.72
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.38
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine with MolForge

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Launch Full Analysis

Related Compounds

(4E,6E)-N-ethyl-7-fluoro-3-methoxy-N,3-dimethyl-4-[(Z)-prop-1-enyl]hepta-4,6-dien-1-amine
CID 144635931
(7Z)-9-fluoro-5-methoxy-N,N,5-trimethyl-6-methylidenedeca-7,9-dien-1-amine
CID 144639506
2-[(3E)-3-[(Z)-but-2-enylidene]-2-methyl-4-methylideneoxolan-2-yl]-N-ethyl-N-methylethanamine
CID 137428940

Frequently Asked Questions

What is the IUPAC name of (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine?
The IUPAC name of (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine (CID 142084753) is (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine.
What is the SMILES notation for (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine?
The canonical SMILES for (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine is C=C(F)/C=C\C(=C)C(C)(CCCN(C)C)OCC.
What is the InChIKey of (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine?
The InChIKey is YUBSKKPTXVPLQQ-KTKRTIGZSA-N. The full InChI is InChI=1S/C15H26FNO/c1-7-18-15(4,11-8-12-17(5)6)13(2)9-10-14(3)16/h9-10H,2-3,7-8,11-12H2,1,4-6H3/b10-9-.
What are the key properties of (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine?
(6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine has a molecular weight of 255.38 g/mol, XLogP of 3.72, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-4-ethoxy-8-fluoro-N,N,4-trimethyl-5-methylidenenona-6,8-dien-1-amine is sourced from PubChem (CID 142084753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).