(Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine

C9H10FNO — CID 139474991

IUPAC(Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine
SMILESC=CN/C(=C\C)c1coc(F)c1
InChIInChI=1S/C9H10FNO/c1-3-8(11-4-2)7-5-9(10)12-6-7/h3-6,11H,2H2,1H3/b8-3-
InChIKeyVTRKYWQKKTVLAB-BAQGIRSFSA-N
MW167.18 g/mol
LogP2.51
Rot. Bonds3

About (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine

(Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine (PubChem CID 139474991) has the molecular formula C9H10FNO and a molecular weight of 167.18 g/mol. Its IUPAC name is (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine
PubChem CID139474991
Molecular FormulaC9H10FNO
Molecular Weight167.18 g/mol
Exact Mass167.07
IUPAC Name(Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine
SMILESC=CN/C(=C\C)c1coc(F)c1
InChIInChI=1S/C9H10FNO/c1-3-8(11-4-2)7-5-9(10)12-6-7/h3-6,11H,2H2,1H3/b8-3-
InChIKeyVTRKYWQKKTVLAB-BAQGIRSFSA-N
XLogP2.51
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine?
The IUPAC name of (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine (CID 139474991) is (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine.
What is the SMILES notation for (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine?
The canonical SMILES for (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine is C=CN/C(=C\C)c1coc(F)c1.
What is the InChIKey of (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine?
The InChIKey is VTRKYWQKKTVLAB-BAQGIRSFSA-N. The full InChI is InChI=1S/C9H10FNO/c1-3-8(11-4-2)7-5-9(10)12-6-7/h3-6,11H,2H2,1H3/b8-3-.
What are the key properties of (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine?
(Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine has a molecular weight of 167.18 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethenyl-1-(5-fluorofuran-3-yl)prop-1-en-1-amine is sourced from PubChem (CID 139474991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).