[2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine

C12H13FN4 — CID 62251604

IUPAC[2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine
SMILESCc1cc(NN)nc(Cc2cccc(F)c2)n1
InChIInChI=1S/C12H13FN4/c1-8-5-12(17-14)16-11(15-8)7-9-3-2-4-10(13)6-9/h2-6H,7,14H2,1H3,(H,15,16,17)
InChIKeyUAQFUECGFQMRFB-UHFFFAOYSA-N
MW232.26 g/mol
LogP1.80
Rot. Bonds3

About [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine

[2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine (PubChem CID 62251604) has the molecular formula C12H13FN4 and a molecular weight of 232.26 g/mol. Its IUPAC name is [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine
PubChem CID62251604
Molecular FormulaC12H13FN4
Molecular Weight232.26 g/mol
Exact Mass232.11
IUPAC Name[2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine
SMILESCc1cc(NN)nc(Cc2cccc(F)c2)n1
InChIInChI=1S/C12H13FN4/c1-8-5-12(17-14)16-11(15-8)7-9-3-2-4-10(13)6-9/h2-6H,7,14H2,1H3,(H,15,16,17)
InChIKeyUAQFUECGFQMRFB-UHFFFAOYSA-N
XLogP1.80
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-ethyl-N-[(3-fluorophenyl)methyl]-6-hydrazinylpyrimidin-4-amine
CID 80939549
[6-methyl-2-[(2-methylphenyl)methyl]pyrimidin-4-yl]hydrazine
CID 62252730
2-[(N-ethyl-3-fluoroanilino)methyl]-N,6-dimethylpyrimidin-4-amine
CID 80657942
5-bromo-2-[(3-fluorophenyl)methyl]-N,6-dimethylpyrimidin-4-amine
CID 66306858
2-benzyl-N-ethyl-6-methylpyrimidin-4-amine
CID 62191071
[2-[[3-(methoxymethyl)phenoxy]methyl]-6-methylpyrimidin-4-yl]hydrazine
CID 80656236
2-[(3-fluorophenyl)methyl]-4,6-dimethylpyrimidine-5-carboxylic acid
CID 62746115
3-[2-[(3-fluorophenyl)methyl]-4,6-dimethylpyrimidin-5-yl]-2-methylpropan-1-amine
CID 65294050
6-tert-butyl-2-[(3-fluorophenyl)methyl]pyrimidin-4-amine
CID 62192622
2-[4,6-diethyl-2-[(3-fluorophenyl)methyl]pyrimidin-5-yl]ethanamine
CID 79219136
[2-[(3-methoxyphenoxy)methyl]-6-methylpyrimidin-4-yl]hydrazine
CID 80656141
3-[(3-fluorophenyl)methyl]-N-methyl-1,2,4-thiadiazol-5-amine
CID 65269198

Frequently Asked Questions

What is the IUPAC name of [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine (CID 62251604) is [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine is Cc1cc(NN)nc(Cc2cccc(F)c2)n1.
What is the InChIKey of [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine?
The InChIKey is UAQFUECGFQMRFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN4/c1-8-5-12(17-14)16-11(15-8)7-9-3-2-4-10(13)6-9/h2-6H,7,14H2,1H3,(H,15,16,17).
What are the key properties of [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine?
[2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine has a molecular weight of 232.26 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-fluorophenyl)methyl]-6-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62251604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).