(5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine

C9H11ClN4 — CID 84621453

IUPAC(5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine
SMILESCc1cc(Cl)cc2nc(NN)n(C)c12
InChIInChI=1S/C9H11ClN4/c1-5-3-6(10)4-7-8(5)14(2)9(12-7)13-11/h3-4H,11H2,1-2H3,(H,12,13)
InChIKeyZGUNKSFJKLBKIK-UHFFFAOYSA-N
MW210.67 g/mol
LogP1.82
Rot. Bonds1

About (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine

(5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine (PubChem CID 84621453) has the molecular formula C9H11ClN4 and a molecular weight of 210.67 g/mol. Its IUPAC name is (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine.

Molecular Properties

Compound Name(5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine
PubChem CID84621453
Molecular FormulaC9H11ClN4
Molecular Weight210.67 g/mol
Exact Mass210.07
IUPAC Name(5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine
SMILESCc1cc(Cl)cc2nc(NN)n(C)c12
InChIInChI=1S/C9H11ClN4/c1-5-3-6(10)4-7-8(5)14(2)9(12-7)13-11/h3-4H,11H2,1-2H3,(H,12,13)
InChIKeyZGUNKSFJKLBKIK-UHFFFAOYSA-N
XLogP1.82
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.67
LogP ≤ 51.82
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-(5-chloro-1,7-dimethylbenzimidazol-2-yl)propan-2-amine
CID 84629021
(4-chloro-2,6-dimethylphenyl)hydrazine
CID 170985099
5-chloro-1,7-dimethylindazole
CID 121266447
2,7-dichloro-3,5-dimethylquinazolin-4-one
CID 114693280
5-bromo-N-(4-chloro-2-methoxy-6-methylphenyl)-1-methyl-7-pentan-3-ylbenzimidazol-2-amine
CID 58012366
5-chloro-7-methylindol-1-amine
CID 96628599
4-chloro-N-(4-chloro-2,6-dimethylphenyl)-7-heptan-4-yl-1-methylbenzimidazol-2-amine
CID 58012338
N'-(1,7-dimethylbenzimidazol-2-yl)ethane-1,2-diamine
CID 83832601
5-chloro-7-methyl-1,3-benzoxazol-2-amine
CID 62368889
2-(5-chloro-7-methylindol-1-yl)ethanamine
CID 130281365
(6-chloro-1,4-dimethylbenzimidazol-2-yl)methanamine
CID 84621320
ethyl 2-(4-chloro-N-[2-(4-chloro-2-methoxy-6-methylanilino)-3-methylbenzimidazol-4-yl]anilino)acetate
CID 58896491

Frequently Asked Questions

What is the IUPAC name of (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine?
The IUPAC name of (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine (CID 84621453) is (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine.
What is the SMILES notation for (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine?
The canonical SMILES for (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine is Cc1cc(Cl)cc2nc(NN)n(C)c12.
What is the InChIKey of (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine?
The InChIKey is ZGUNKSFJKLBKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN4/c1-5-3-6(10)4-7-8(5)14(2)9(12-7)13-11/h3-4H,11H2,1-2H3,(H,12,13).
What are the key properties of (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine?
(5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine has a molecular weight of 210.67 g/mol, XLogP of 1.82, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1,7-dimethylbenzimidazol-2-yl)hydrazine is sourced from PubChem (CID 84621453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).