1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine

C16H17FN2O — CID 144838636

IUPAC1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine
SMILESCN(N)c1cc(F)cc(C2CC2)c1/C=C/c1ccco1
InChIInChI=1S/C16H17FN2O/c1-19(18)16-10-12(17)9-15(11-4-5-11)14(16)7-6-13-3-2-8-20-13/h2-3,6-11H,4-5,18H2,1H3/b7-6+
InChIKeyIDYAWWFYSMYROL-VOTSOKGWSA-N
MW272.32 g/mol
LogP3.78
Rot. Bonds4

About 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine

1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine (PubChem CID 144838636) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine.

Molecular Properties

Compound Name1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine
PubChem CID144838636
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC Name1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine
SMILESCN(N)c1cc(F)cc(C2CC2)c1/C=C/c1ccco1
InChIInChI=1S/C16H17FN2O/c1-19(18)16-10-12(17)9-15(11-4-5-11)14(16)7-6-13-3-2-8-20-13/h2-3,6-11H,4-5,18H2,1H3/b7-6+
InChIKeyIDYAWWFYSMYROL-VOTSOKGWSA-N
XLogP3.78
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

formohydrazide;1-[2-[(E)-2-(furan-2-yl)ethenyl]-3-(trifluoromethyl)phenyl]-1-methylhydrazine
CID 144838244
1-[3-cyclopropyl-2-[(E)-2-(5-fluorothiophen-2-yl)ethenyl]phenyl]-1-methylhydrazine
CID 144838823
1-[3-ethenyl-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine;formohydrazide
CID 144838869
1-[3-bromo-2-[(E)-2-(4-methylfuran-2-yl)ethenyl]phenyl]-1-methylhydrazine
CID 144838433
(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide
CID 11480633
2-[(Z)-2-chloroethenyl]furan
CID 11389398
2-[(E)-2-fluoroethenyl]furan
CID 145208016
1-[2-[(E)-2-(2-cyclopropylphenyl)ethenyl]-3-(trifluoromethyl)phenyl]-1-methylhydrazine;formohydrazide
CID 144839061
2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan
CID 123596794
1-[(1S,5R)-3-[(E)-3-(furan-2-yl)prop-2-enyl]-3-azabicyclo[3.1.0]hexan-6-yl]-N,N-dimethylmethanamine
CID 56884981
1-[3-ethyl-2-[(E)-2-(4-fluorofuran-2-yl)ethenyl]phenyl]-1-methylhydrazine;formohydrazide
CID 144837932
2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan
CID 91360504

Frequently Asked Questions

What is the IUPAC name of 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine?
The IUPAC name of 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine (CID 144838636) is 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine.
What is the SMILES notation for 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine?
The canonical SMILES for 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine is CN(N)c1cc(F)cc(C2CC2)c1/C=C/c1ccco1.
What is the InChIKey of 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine?
The InChIKey is IDYAWWFYSMYROL-VOTSOKGWSA-N. The full InChI is InChI=1S/C16H17FN2O/c1-19(18)16-10-12(17)9-15(11-4-5-11)14(16)7-6-13-3-2-8-20-13/h2-3,6-11H,4-5,18H2,1H3/b7-6+.
What are the key properties of 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine?
1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine has a molecular weight of 272.32 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-cyclopropyl-5-fluoro-2-[(E)-2-(furan-2-yl)ethenyl]phenyl]-1-methylhydrazine is sourced from PubChem (CID 144838636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).