(E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine

C17H26FN3 — CID 143915749

IUPAC(E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine
SMILESCC/C=C(/F)Cc1cc(/C(C)=C/NC)cn(CC)/c1=N\C
InChIInChI=1S/C17H26FN3/c1-6-8-16(18)10-14-9-15(13(3)11-19-4)12-21(7-2)17(14)20-5/h8-9,11-12,19H,6-7,10H2,1-5H3/b13-11+,16-8+,20-17-
InChIKeyCFOJGCWJYYTMPY-MPIZJKHDSA-N
MW291.41 g/mol
LogP3.42
Rot. Bonds6

About (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine

(E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine (PubChem CID 143915749) has the molecular formula C17H26FN3 and a molecular weight of 291.41 g/mol. Its IUPAC name is (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine.

Molecular Properties

Compound Name(E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine
PubChem CID143915749
Molecular FormulaC17H26FN3
Molecular Weight291.41 g/mol
Exact Mass291.21
IUPAC Name(E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine
SMILESCC/C=C(/F)Cc1cc(/C(C)=C/NC)cn(CC)/c1=N\C
InChIInChI=1S/C17H26FN3/c1-6-8-16(18)10-14-9-15(13(3)11-19-4)12-21(7-2)17(14)20-5/h8-9,11-12,19H,6-7,10H2,1-5H3/b13-11+,16-8+,20-17-
InChIKeyCFOJGCWJYYTMPY-MPIZJKHDSA-N
XLogP3.42
TPSA29.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.41
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine with MolForge

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Related Compounds

N'-ethyl-N-methyl-N'-[(3E)-3-[(Z)-4,4,4-trifluoro-3-(methylamino)but-2-enylidene]-4H-pyridin-2-yl]propane-1,3-diamine
CID 143235798
(E)-5-(5-ethyl-6-imino-1-propan-2-ylpyrimidin-4-yl)-N-(2-fluoroethyl)-4-methylpent-4-en-1-amine
CID 170077933
3,6-diethyl-N-methyl-1,2-dihydroazepin-7-imine
CID 136646954
N'-methyl-N-propylcyclohexa-1,5-diene-1-carboximidamide
CID 143258576
(3Z)-N,4-dimethyl-3-propylidene-1H-pyrrol-2-imine;ethane
CID 144116944
(2-ethenyl-1,4-dimethyl-6-propan-2-ylimino-2H-pyridin-5-ylidene)methanamine
CID 173759244
(3E)-3-ethylidene-4-methylidene-N,N-dipropylpyridin-2-amine
CID 144005051

Frequently Asked Questions

What is the IUPAC name of (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine?
The IUPAC name of (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine (CID 143915749) is (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine.
What is the SMILES notation for (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine?
The canonical SMILES for (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine is CC/C=C(/F)Cc1cc(/C(C)=C/NC)cn(CC)/c1=N\C.
What is the InChIKey of (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine?
The InChIKey is CFOJGCWJYYTMPY-MPIZJKHDSA-N. The full InChI is InChI=1S/C17H26FN3/c1-6-8-16(18)10-14-9-15(13(3)11-19-4)12-21(7-2)17(14)20-5/h8-9,11-12,19H,6-7,10H2,1-5H3/b13-11+,16-8+,20-17-.
What are the key properties of (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine?
(E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine has a molecular weight of 291.41 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-[1-ethyl-5-[(E)-2-fluoropent-2-enyl]-6-methylimino-3-pyridinyl]-N-methylprop-1-en-1-amine is sourced from PubChem (CID 143915749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).