N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine

C11H12FN5 — CID 80944638

IUPACN-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine
SMILESNNc1cncc(NCc2ccc(F)cc2)n1
InChIInChI=1S/C11H12FN5/c12-9-3-1-8(2-4-9)5-15-10-6-14-7-11(16-10)17-13/h1-4,6-7H,5,13H2,(H2,15,16,17)
InChIKeyHFBQOBJEGDWRQI-UHFFFAOYSA-N
MW233.25 g/mol
LogP1.51
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine

N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine (PubChem CID 80944638) has the molecular formula C11H12FN5 and a molecular weight of 233.25 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine
PubChem CID80944638
Molecular FormulaC11H12FN5
Molecular Weight233.25 g/mol
Exact Mass233.11
IUPAC NameN-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine
SMILESNNc1cncc(NCc2ccc(F)cc2)n1
InChIInChI=1S/C11H12FN5/c12-9-3-1-8(2-4-9)5-15-10-6-14-7-11(16-10)17-13/h1-4,6-7H,5,13H2,(H2,15,16,17)
InChIKeyHFBQOBJEGDWRQI-UHFFFAOYSA-N
XLogP1.51
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.25
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

4-N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrimidine-2,4-diamine
CID 80943551
6-(2-amino-5-chloro-4-pyridinyl)-N-[(4-fluorophenyl)methyl]pyrazin-2-amine
CID 67980486
N-[(4-fluorophenyl)methyl]-1,3-thiazol-5-amine
CID 91208899
6-hydrazinyl-N-(thiophen-2-ylmethyl)pyrazin-2-amine
CID 80942638
2-N-[(3,4-difluorophenyl)methyl]pyrazine-2,6-diamine
CID 78988973
2-N-[(3,4-difluorophenyl)methyl]-6-N-methylpyrazine-2,6-diamine
CID 80805540
2-N-benzylpyrazine-2,6-diamine
CID 70838336
2-N-[(4-bromophenyl)methyl]-6-N-propylpyrazine-2,6-diamine
CID 80755206
5-N-[(4-fluorophenyl)methyl]-3-N-propyl-1,2,4-triazine-3,5-diamine
CID 112938520
5-N-[(4-fluorophenyl)methyl]-3-N-[(4-methoxyphenyl)methyl]-1,2,4-triazine-3,5-diamine
CID 112949865
N-[(4-fluorophenyl)methyl]-6-methyl-2-methylsulfanylpyrimidin-4-amine
CID 171705235
N-(4-fluoro-2-methylphenyl)-6-hydrazinylpyrazin-2-amine
CID 80927661

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine?
The IUPAC name of N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine (CID 80944638) is N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine is NNc1cncc(NCc2ccc(F)cc2)n1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine?
The InChIKey is HFBQOBJEGDWRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN5/c12-9-3-1-8(2-4-9)5-15-10-6-14-7-11(16-10)17-13/h1-4,6-7H,5,13H2,(H2,15,16,17).
What are the key properties of N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine?
N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine has a molecular weight of 233.25 g/mol, XLogP of 1.51, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-6-hydrazinylpyrazin-2-amine is sourced from PubChem (CID 80944638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).