[2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine

C16H24N4S — CID 105320892

IUPAC[2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine
SMILESCCCn1c(CC(NN)C2CCSC2)nc2ccccc21
InChIInChI=1S/C16H24N4S/c1-2-8-20-15-6-4-3-5-13(15)18-16(20)10-14(19-17)12-7-9-21-11-12/h3-6,12,14,19H,2,7-11,17H2,1H3
InChIKeyAFQZPGJZAHEJPA-UHFFFAOYSA-N
MW304.46 g/mol
LogP2.57
Rot. Bonds6

About [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine

[2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine (PubChem CID 105320892) has the molecular formula C16H24N4S and a molecular weight of 304.46 g/mol. Its IUPAC name is [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine
PubChem CID105320892
Molecular FormulaC16H24N4S
Molecular Weight304.46 g/mol
Exact Mass304.17
IUPAC Name[2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine
SMILESCCCn1c(CC(NN)C2CCSC2)nc2ccccc21
InChIInChI=1S/C16H24N4S/c1-2-8-20-15-6-4-3-5-13(15)18-16(20)10-14(19-17)12-7-9-21-11-12/h3-6,12,14,19H,2,7-11,17H2,1H3
InChIKeyAFQZPGJZAHEJPA-UHFFFAOYSA-N
XLogP2.57
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

1-cyclopropyl-2-(1-propylbenzimidazol-2-yl)ethanamine
CID 79754023
[2-(1-methylbenzimidazol-2-yl)-1-(1,4-oxathian-2-yl)ethyl]hydrazine
CID 105249700
1-(3-methylcyclopentyl)-2-(1-propylbenzimidazol-2-yl)ethanamine
CID 79757049
[1,1,1-trifluoro-3-(1-propylbenzimidazol-2-yl)propan-2-yl]hydrazine
CID 105215870
N-methyl-1-(oxolan-3-yl)-2-(1-propylbenzimidazol-2-yl)ethanamine
CID 79757032
1-cyclobutyl-3-(1-propylbenzimidazol-2-yl)propan-2-ol
CID 103170121
2-(1-methylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethanol
CID 105111555
1-(oxan-4-yl)-2-(1-propylbenzimidazol-2-yl)ethanamine
CID 79757035
1-cyclopropyl-2-[(1-propylbenzimidazol-2-yl)methylamino]ethanol
CID 63299001
[1-(furan-2-yl)-2-(1-propylbenzimidazol-2-yl)ethyl]hydrazine
CID 105213713
[3-methoxy-1-(1-propylbenzimidazol-2-yl)pentan-2-yl]hydrazine
CID 105270881
1-(6-bicyclo[3.1.0]hexanyl)-2-(1-propylbenzimidazol-2-yl)ethanol
CID 115818131

Frequently Asked Questions

What is the IUPAC name of [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine (CID 105320892) is [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine is CCCn1c(CC(NN)C2CCSC2)nc2ccccc21.
What is the InChIKey of [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine?
The InChIKey is AFQZPGJZAHEJPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4S/c1-2-8-20-15-6-4-3-5-13(15)18-16(20)10-14(19-17)12-7-9-21-11-12/h3-6,12,14,19H,2,7-11,17H2,1H3.
What are the key properties of [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine?
[2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine has a molecular weight of 304.46 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-propylbenzimidazol-2-yl)-1-(thiolan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105320892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).