(6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine

C8H11FN2 — CID 143119737

IUPAC(6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine
SMILESCC1=C(NN)C=C(F)C=CC1
InChIInChI=1S/C8H11FN2/c1-6-3-2-4-7(9)5-8(6)11-10/h2,4-5,11H,3,10H2,1H3
InChIKeyGZUBPNJVQNFMQR-UHFFFAOYSA-N
MW154.19 g/mol
LogP1.54
Rot. Bonds1

About (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine

(6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine (PubChem CID 143119737) has the molecular formula C8H11FN2 and a molecular weight of 154.19 g/mol. Its IUPAC name is (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine.

Molecular Properties

Compound Name(6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine
PubChem CID143119737
Molecular FormulaC8H11FN2
Molecular Weight154.19 g/mol
Exact Mass154.09
IUPAC Name(6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine
SMILESCC1=C(NN)C=C(F)C=CC1
InChIInChI=1S/C8H11FN2/c1-6-3-2-4-7(9)5-8(6)11-10/h2,4-5,11H,3,10H2,1H3
InChIKeyGZUBPNJVQNFMQR-UHFFFAOYSA-N
XLogP1.54
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(5-Fluorocyclohepta-1,4,6-trien-1-yl)hydrazine
CID 139334698
[(3E,5Z)-3-fluoro-4-methylhepta-1,3,5-trien-2-yl]hydrazine
CID 143782177
[(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine
CID 143936287
[(3E)-5-fluoro-2-methylhexa-1,3,5-trien-3-yl]hydrazine
CID 156837174
[(2E,4E)-6-methyl-4-(trifluoromethyl)hepta-2,4,6-trien-2-yl]hydrazine
CID 143772149
3-Fluoro-6-methyl-4-propan-2-yl-1,2-dihydropyridazine
CID 177039274
(2-Methylbenzene-5-id-1-yl)hydrazine;yttrium
CID 57678810
(4-Methylbenzene-6-id-1-yl)hydrazine;yttrium
CID 58961529
[(3Z)-4,8-dimethyl-7-methylidenenona-1,3,8-trien-3-yl]hydrazine
CID 88993322
[(5Z)-4-methylidenehepta-1,5-dien-2-yl]hydrazine
CID 121325608
(2-Ethylcyclopenta-1,4-dien-1-yl)hydrazine
CID 126655128
[(2E,4Z)-4-methylhepta-2,4,6-trien-2-yl]hydrazine
CID 129025143

Frequently Asked Questions

What is the IUPAC name of (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine?
The IUPAC name of (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine (CID 143119737) is (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine.
What is the SMILES notation for (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine?
The canonical SMILES for (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine is CC1=C(NN)C=C(F)C=CC1.
What is the InChIKey of (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine?
The InChIKey is GZUBPNJVQNFMQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2/c1-6-3-2-4-7(9)5-8(6)11-10/h2,4-5,11H,3,10H2,1H3.
What are the key properties of (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine?
(6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine has a molecular weight of 154.19 g/mol, XLogP of 1.54, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-2-methylcyclohepta-1,4,6-trien-1-yl)hydrazine is sourced from PubChem (CID 143119737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).