3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine

C9H14FN — CID 164585830

IUPAC3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine
SMILESC/C(=C/F)C1=CCCC(N)C1
InChIInChI=1S/C9H14FN/c1-7(6-10)8-3-2-4-9(11)5-8/h3,6,9H,2,4-5,11H2,1H3/b7-6-
InChIKeyHYFYKXCCXJQWPF-SREVYHEPSA-N
MW155.22 g/mol
LogP2.30
Rot. Bonds1

About 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine

3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine (PubChem CID 164585830) has the molecular formula C9H14FN and a molecular weight of 155.22 g/mol. Its IUPAC name is 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine.

Molecular Properties

Compound Name3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine
PubChem CID164585830
Molecular FormulaC9H14FN
Molecular Weight155.22 g/mol
Exact Mass155.11
IUPAC Name3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine
SMILESC/C(=C/F)C1=CCCC(N)C1
InChIInChI=1S/C9H14FN/c1-7(6-10)8-3-2-4-9(11)5-8/h3,6,9H,2,4-5,11H2,1H3/b7-6-
InChIKeyHYFYKXCCXJQWPF-SREVYHEPSA-N
XLogP2.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.22
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine?
The IUPAC name of 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine (CID 164585830) is 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine.
What is the SMILES notation for 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine?
The canonical SMILES for 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine is C/C(=C/F)C1=CCCC(N)C1.
What is the InChIKey of 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine?
The InChIKey is HYFYKXCCXJQWPF-SREVYHEPSA-N. The full InChI is InChI=1S/C9H14FN/c1-7(6-10)8-3-2-4-9(11)5-8/h3,6,9H,2,4-5,11H2,1H3/b7-6-.
What are the key properties of 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine?
3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine has a molecular weight of 155.22 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-1-fluoroprop-1-en-2-yl]cyclohex-3-en-1-amine is sourced from PubChem (CID 164585830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).