[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine

C10H12FN5 — CID 71069724

IUPAC[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine
SMILESCc1ncnn1-c1cc(F)ccc1CNN
InChIInChI=1S/C10H12FN5/c1-7-13-6-15-16(7)10-4-9(11)3-2-8(10)5-14-12/h2-4,6,14H,5,12H2,1H3
InChIKeySDFXOEAPGUBWRW-UHFFFAOYSA-N
MW221.24 g/mol
LogP0.68
Rot. Bonds3

About [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine

[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine (PubChem CID 71069724) has the molecular formula C10H12FN5 and a molecular weight of 221.24 g/mol. Its IUPAC name is [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine.

Molecular Properties

Compound Name[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine
PubChem CID71069724
Molecular FormulaC10H12FN5
Molecular Weight221.24 g/mol
Exact Mass221.11
IUPAC Name[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine
SMILESCc1ncnn1-c1cc(F)ccc1CNN
InChIInChI=1S/C10H12FN5/c1-7-13-6-15-16(7)10-4-9(11)3-2-8(10)5-14-12/h2-4,6,14H,5,12H2,1H3
InChIKeySDFXOEAPGUBWRW-UHFFFAOYSA-N
XLogP0.68
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.24
LogP ≤ 50.68
H-Bond Donors ≤ 52
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-fluoro-2-(triazol-2-yl)phenyl]methylhydrazine
CID 70960169
1-(2-bromo-5-fluorophenyl)-5-methyl-1,2,4-triazole;molecular nitrogen
CID 141178204
(4-fluoro-2-methylphenyl)methylhydrazine
CID 62134816
1-(2-bromo-5-fluorophenyl)-5-methyl-1,2,4-triazole;copper(1+);ethane;4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)benzonitrile;[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methanamine;cyanide
CID 162199394
N-[[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methyl]-3-hydroxy-4-oxospiro[7,9-dihydro-6H-pyrimido[1,2-d][1,4]oxazepine-10,4'-oxane]-2-carboxamide
CID 54705125
1-ethyl-N-[[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methyl]-5-hydroxy-2-[4-(hydroxymethyl)oxan-4-yl]-6-oxopyrimidine-4-carboxamide
CID 70905123
5-fluoro-2-(hydrazinylmethyl)phenol;hydrochloride
CID 154729993
methyl 9-[[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylcarbamoyl]-8-hydroxy-7-oxospiro[4,5-dihydro-3H-pyrido[2,1-c][1,4]oxazepine-10,4'-piperidine]-1'-carboxylate
CID 69495731
2-(2,4-difluorophenyl)-1,2,4-triazol-3-amine
CID 62677520
methyl 9-[[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylcarbamoyl]-7,8-dioxospiro[2,4,5,9-tetrahydropyrido[1,2-d][1,4]oxazepine-10,4'-piperidine]-1'-carboxylate
CID 91387320
benzyl 9-[[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylcarbamoyl]-8-hydroxy-7-oxospiro[4,5-dihydro-2H-pyrido[1,2-d][1,4]oxazepine-10,4'-piperidine]-1'-carboxylate
CID 69495868
2-[2-(aminomethyl)-5-fluorophenyl]-4,5-dimethyl-1,2,4-triazol-3-one;hydrochloride
CID 67439483

Frequently Asked Questions

What is the IUPAC name of [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine?
The IUPAC name of [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine (CID 71069724) is [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine.
What is the SMILES notation for [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine?
The canonical SMILES for [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine is Cc1ncnn1-c1cc(F)ccc1CNN.
What is the InChIKey of [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine?
The InChIKey is SDFXOEAPGUBWRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN5/c1-7-13-6-15-16(7)10-4-9(11)3-2-8(10)5-14-12/h2-4,6,14H,5,12H2,1H3.
What are the key properties of [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine?
[4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine has a molecular weight of 221.24 g/mol, XLogP of 0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-fluoro-2-(5-methyl-1,2,4-triazol-1-yl)phenyl]methylhydrazine is sourced from PubChem (CID 71069724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).