[6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine

C14H16N6 — CID 80900481

IUPAC[6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)cc(-n2cnc3cc(C)c(C)cc32)n1
InChIInChI=1S/C14H16N6/c1-8-4-11-12(5-9(8)2)20(7-16-11)14-6-13(19-15)17-10(3)18-14/h4-7H,15H2,1-3H3,(H,17,18,19)
InChIKeyYLBXQYFQWSVDML-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.03
Rot. Bonds2

About [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine

[6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine (PubChem CID 80900481) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine
PubChem CID80900481
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC Name[6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine
SMILESCc1nc(NN)cc(-n2cnc3cc(C)c(C)cc32)n1
InChIInChI=1S/C14H16N6/c1-8-4-11-12(5-9(8)2)20(7-16-11)14-6-13(19-15)17-10(3)18-14/h4-7H,15H2,1-3H3,(H,17,18,19)
InChIKeyYLBXQYFQWSVDML-UHFFFAOYSA-N
XLogP2.03
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-(5,6-dimethylbenzimidazol-1-yl)-6-hydrazinylpyrimidin-2-amine
CID 80901487
4-(5,6-dimethylbenzimidazol-1-yl)-6-methylpyrimidin-2-amine
CID 112726059
6-(5,6-dimethylbenzimidazol-1-yl)-N-methylpyrimidin-4-amine
CID 80853780
[4-(5,6-dimethylbenzimidazol-1-yl)-5-methylpyrimidin-2-yl]hydrazine
CID 80902137
[4-(5,6-dimethylbenzimidazol-1-yl)-5-fluoropyrimidin-2-yl]hydrazine
CID 80900657
1-[3,5-bis(5,6-dimethylbenzimidazol-1-yl)-2,4,6-trimethylphenyl]-5,6-dimethylbenzimidazole
CID 122202423
1-(6-chloro-2-propylpyrimidin-4-yl)-5,6-dimethylbenzimidazole
CID 80939782
2-(5,6-dimethylbenzimidazol-1-yl)quinoline
CID 17411926
6-(5,6-dimethylbenzimidazol-1-yl)pyrazine-2-carboxylic acid
CID 66455454
1-[2-(5,6-dimethylbenzimidazol-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 62293983
5-(5,6-dimethylbenzimidazol-1-yl)-1,3-dimethylpyrazol-4-amine
CID 43554356
(2,6-dimethylpyrimidin-4-yl)hydrazine
CID 736395

Frequently Asked Questions

What is the IUPAC name of [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine (CID 80900481) is [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine is Cc1nc(NN)cc(-n2cnc3cc(C)c(C)cc32)n1.
What is the InChIKey of [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine?
The InChIKey is YLBXQYFQWSVDML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c1-8-4-11-12(5-9(8)2)20(7-16-11)14-6-13(19-15)17-10(3)18-14/h4-7H,15H2,1-3H3,(H,17,18,19).
What are the key properties of [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine?
[6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine has a molecular weight of 268.32 g/mol, XLogP of 2.03, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 80900481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).