[2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine

C14H17FN4 — CID 62916072

IUPAC[2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1nc(-c2ccc(F)cc2)nc(NN)c1C(C)C
InChIInChI=1S/C14H17FN4/c1-8(2)12-9(3)17-13(18-14(12)19-16)10-4-6-11(15)7-5-10/h4-8H,16H2,1-3H3,(H,17,18,19)
InChIKeyXKSYZKGMMUZZFF-UHFFFAOYSA-N
MW260.32 g/mol
LogP3.00
Rot. Bonds3

About [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine

[2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine (PubChem CID 62916072) has the molecular formula C14H17FN4 and a molecular weight of 260.32 g/mol. Its IUPAC name is [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine
PubChem CID62916072
Molecular FormulaC14H17FN4
Molecular Weight260.32 g/mol
Exact Mass260.14
IUPAC Name[2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine
SMILESCc1nc(-c2ccc(F)cc2)nc(NN)c1C(C)C
InChIInChI=1S/C14H17FN4/c1-8(2)12-9(3)17-13(18-14(12)19-16)10-4-6-11(15)7-5-10/h4-8H,16H2,1-3H3,(H,17,18,19)
InChIKeyXKSYZKGMMUZZFF-UHFFFAOYSA-N
XLogP3.00
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.32
LogP ≤ 53.00
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

Diamino-5-phenyl-6-ethylpyrimidine, 2,4-
CID 93114
2,4-Pyrimidinediamine, 6-hexyl-5-phenyl-
CID 9881905
6-Ethyl-5-(4-methylphenyl)pyrimidine-2,4-diamine
CID 11020649
6-Methyl-5-phenyl-2,4-pyrimidinediamine
CID 72565
Ferimzone
CID 9013425
N-benzyl-4-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-6-methylpyrimidin-2-amine
CID 9629464
2,4-Pyrimidinediamine, 6-methyl-5-(3-phenylpropyl)-
CID 308637
2-Hydrazino-4-(4-methylphenyl)-6-phenylpyrimidine
CID 780062
6-Ethyl-5-(3-phenylprop-1-yn-1-yl)pyrimidine-2,4-diamine
CID 25138227
1-(4-Fluorophenyl)ethanone (4-methyl-6-phenyl-2-pyrimidinyl)hydrazone
CID 5332853
4-[(2E)-2-benzylidenehydrazinyl]-6-methylpyrimidin-2-amine
CID 9622005
N-benzyl-4-[(2E)-2-(2-fluorobenzylidene)hydrazinyl]-6-methylpyrimidin-2-amine
CID 9631618

Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The IUPAC name of [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine (CID 62916072) is [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine is Cc1nc(-c2ccc(F)cc2)nc(NN)c1C(C)C.
What is the InChIKey of [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine?
The InChIKey is XKSYZKGMMUZZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN4/c1-8(2)12-9(3)17-13(18-14(12)19-16)10-4-6-11(15)7-5-10/h4-8H,16H2,1-3H3,(H,17,18,19).
What are the key properties of [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine?
[2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine has a molecular weight of 260.32 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62916072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).