4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine

C14H19N7 — CID 105231084

IUPAC4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
SMILESCCn1c(CC(NN)c2cn[nH]c2N)nc2ccccc21
InChIInChI=1S/C14H19N7/c1-2-21-12-6-4-3-5-10(12)18-13(21)7-11(19-16)9-8-17-20-14(9)15/h3-6,8,11,19H,2,7,16H2,1H3,(H3,15,17,20)
InChIKeyPEQWWRIOSOGCML-UHFFFAOYSA-N
MW285.36 g/mol
LogP1.11
Rot. Bonds5

About 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine

4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine (PubChem CID 105231084) has the molecular formula C14H19N7 and a molecular weight of 285.36 g/mol. Its IUPAC name is 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
PubChem CID105231084
Molecular FormulaC14H19N7
Molecular Weight285.36 g/mol
Exact Mass285.17
IUPAC Name4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine
SMILESCCn1c(CC(NN)c2cn[nH]c2N)nc2ccccc21
InChIInChI=1S/C14H19N7/c1-2-21-12-6-4-3-5-10(12)18-13(21)7-11(19-16)9-8-17-20-14(9)15/h3-6,8,11,19H,2,7,16H2,1H3,(H3,15,17,20)
InChIKeyPEQWWRIOSOGCML-UHFFFAOYSA-N
XLogP1.11
TPSA110.57 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 51.11
H-Bond Donors ≤ 54
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

[2-(1-ethylbenzimidazol-2-yl)-1-pyridazin-4-ylethyl]hydrazine
CID 105321121
[2-(1-ethylbenzimidazol-2-yl)-1-thiophen-2-ylethyl]hydrazine
CID 105193559
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(1H-1,2,4-triazol-5-yl)ethanamine
CID 79750862
[2-(1-propylbenzimidazol-2-yl)-1-(1H-1,2,4-triazol-5-yl)ethyl]hydrazine
CID 105230658
(1-ethylbenzimidazol-2-yl)methylhydrazine
CID 53275104
[1-(1-ethylbenzimidazol-2-yl)-3-propan-2-yloxypropan-2-yl]hydrazine
CID 105321101
1-(1-ethylbenzimidazol-2-yl)propan-2-ol
CID 79753828
[1-(1-ethylbenzimidazol-2-yl)-3-methoxy-4-methylpentan-2-yl]hydrazine
CID 105272000
[1-butan-2-ylsulfanyl-3-(1-ethylbenzimidazol-2-yl)propan-2-yl]hydrazine
CID 105227069
2-(1-ethylbenzimidazol-2-yl)-1-(4-fluorophenyl)ethanol
CID 79754584
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-pyridin-2-ylethanamine
CID 79756296
2-(1-ethylbenzimidazol-2-yl)-N-methyl-1-(5-methylfuran-3-yl)ethanamine
CID 105007716

Frequently Asked Questions

What is the IUPAC name of 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The IUPAC name of 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine (CID 105231084) is 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine.
What is the SMILES notation for 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The canonical SMILES for 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine is CCn1c(CC(NN)c2cn[nH]c2N)nc2ccccc21.
What is the InChIKey of 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
The InChIKey is PEQWWRIOSOGCML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N7/c1-2-21-12-6-4-3-5-10(12)18-13(21)7-11(19-16)9-8-17-20-14(9)15/h3-6,8,11,19H,2,7,16H2,1H3,(H3,15,17,20).
What are the key properties of 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine?
4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine has a molecular weight of 285.36 g/mol, XLogP of 1.11, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1-ethylbenzimidazol-2-yl)-1-hydrazinylethyl]-1H-pyrazol-5-amine is sourced from PubChem (CID 105231084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).