(Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine

C9H15FN2 — CID 146644462

IUPAC(Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine
SMILESC=C(F)/C=C(\C)N(C)/C=C\NC
InChIInChI=1S/C9H15FN2/c1-8(10)7-9(2)12(4)6-5-11-3/h5-7,11H,1H2,2-4H3/b6-5-,9-7+
InChIKeyMBFMTFUXWIRLBC-BZWSEGBZSA-N
MW170.23 g/mol
LogP2.00
Rot. Bonds4

About (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine

(Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine (PubChem CID 146644462) has the molecular formula C9H15FN2 and a molecular weight of 170.23 g/mol. Its IUPAC name is (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine
PubChem CID146644462
Molecular FormulaC9H15FN2
Molecular Weight170.23 g/mol
Exact Mass170.12
IUPAC Name(Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine
SMILESC=C(F)/C=C(\C)N(C)/C=C\NC
InChIInChI=1S/C9H15FN2/c1-8(10)7-9(2)12(4)6-5-11-3/h5-7,11H,1H2,2-4H3/b6-5-,9-7+
InChIKeyMBFMTFUXWIRLBC-BZWSEGBZSA-N
XLogP2.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.23
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine?
The IUPAC name of (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine (CID 146644462) is (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine.
What is the SMILES notation for (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine?
The canonical SMILES for (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine is C=C(F)/C=C(\C)N(C)/C=C\NC.
What is the InChIKey of (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine?
The InChIKey is MBFMTFUXWIRLBC-BZWSEGBZSA-N. The full InChI is InChI=1S/C9H15FN2/c1-8(10)7-9(2)12(4)6-5-11-3/h5-7,11H,1H2,2-4H3/b6-5-,9-7+.
What are the key properties of (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine?
(Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine has a molecular weight of 170.23 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-[(2E)-4-fluoropenta-2,4-dien-2-yl]-N,N'-dimethylethene-1,2-diamine is sourced from PubChem (CID 146644462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).