(E)-3-fluoro-5-methylhex-2-en-1-amine

C7H14FN — CID 59533928

IUPAC(E)-3-fluoro-5-methylhex-2-en-1-amine
SMILESCC(C)C/C(F)=C\CN
InChIInChI=1S/C7H14FN/c1-6(2)5-7(8)3-4-9/h3,6H,4-5,9H2,1-2H3/b7-3+
InChIKeyHOUDKEYTEYAZPW-XVNBXDOJSA-N
MW131.19 g/mol
LogP1.84
Rot. Bonds3

About (E)-3-fluoro-5-methylhex-2-en-1-amine

(E)-3-fluoro-5-methylhex-2-en-1-amine (PubChem CID 59533928) has the molecular formula C7H14FN and a molecular weight of 131.19 g/mol. Its IUPAC name is (E)-3-fluoro-5-methylhex-2-en-1-amine.

Molecular Properties

Compound Name(E)-3-fluoro-5-methylhex-2-en-1-amine
PubChem CID59533928
Molecular FormulaC7H14FN
Molecular Weight131.19 g/mol
Exact Mass131.11
IUPAC Name(E)-3-fluoro-5-methylhex-2-en-1-amine
SMILESCC(C)C/C(F)=C\CN
InChIInChI=1S/C7H14FN/c1-6(2)5-7(8)3-4-9/h3,6H,4-5,9H2,1-2H3/b7-3+
InChIKeyHOUDKEYTEYAZPW-XVNBXDOJSA-N
XLogP1.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.19
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(E)-2-fluoro-5-methylhex-2-en-1-amine
CID 59533936
3-Fluoro-6-methylcyclohexa-2,4-dien-1-amine
CID 68045101
(E)-5-(fluoromethyl)hept-2-en-1-amine
CID 87633570
(E)-3-fluoropent-2-en-1-amine
CID 89018765
(2Z)-2-methyl-4-(trifluoromethyl)hepta-2,6-dien-1-amine
CID 89073932
(Z)-2-ethyl-5-fluorohex-3-en-1-amine
CID 89090863
(E)-6,6,6-trifluoro-2,5-dimethylhex-2-en-1-amine
CID 89153804
(E)-4-fluorohex-4-en-1-amine
CID 89199983
(E,2S)-3-fluorohept-3-en-2-amine
CID 89217750
(E)-2-fluoropent-2-en-1-amine
CID 89938437
5-(Fluoromethyl)hept-2-en-1-amine
CID 91369238
4-Fluoro-6-methylcyclohexa-2,4-dien-1-amine
CID 118674973

Frequently Asked Questions

What is the IUPAC name of (E)-3-fluoro-5-methylhex-2-en-1-amine?
The IUPAC name of (E)-3-fluoro-5-methylhex-2-en-1-amine (CID 59533928) is (E)-3-fluoro-5-methylhex-2-en-1-amine.
What is the SMILES notation for (E)-3-fluoro-5-methylhex-2-en-1-amine?
The canonical SMILES for (E)-3-fluoro-5-methylhex-2-en-1-amine is CC(C)C/C(F)=C\CN.
What is the InChIKey of (E)-3-fluoro-5-methylhex-2-en-1-amine?
The InChIKey is HOUDKEYTEYAZPW-XVNBXDOJSA-N. The full InChI is InChI=1S/C7H14FN/c1-6(2)5-7(8)3-4-9/h3,6H,4-5,9H2,1-2H3/b7-3+.
What are the key properties of (E)-3-fluoro-5-methylhex-2-en-1-amine?
(E)-3-fluoro-5-methylhex-2-en-1-amine has a molecular weight of 131.19 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-fluoro-5-methylhex-2-en-1-amine is sourced from PubChem (CID 59533928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).