[1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine

C16H19N5 — CID 105212470

IUPAC[1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine
SMILESCn1c(CC(Cc2ccncc2)NN)nc2ccccc21
InChIInChI=1S/C16H19N5/c1-21-15-5-3-2-4-14(15)19-16(21)11-13(20-17)10-12-6-8-18-9-7-12/h2-9,13,20H,10-11,17H2,1H3
InChIKeyPGXHNSQLQHJNEB-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.59
Rot. Bonds5

About [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine

[1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine (PubChem CID 105212470) has the molecular formula C16H19N5 and a molecular weight of 281.36 g/mol. Its IUPAC name is [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine
PubChem CID105212470
Molecular FormulaC16H19N5
Molecular Weight281.36 g/mol
Exact Mass281.16
IUPAC Name[1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine
SMILESCn1c(CC(Cc2ccncc2)NN)nc2ccccc21
InChIInChI=1S/C16H19N5/c1-21-15-5-3-2-4-14(15)19-16(21)11-13(20-17)10-12-6-8-18-9-7-12/h2-9,13,20H,10-11,17H2,1H3
InChIKeyPGXHNSQLQHJNEB-UHFFFAOYSA-N
XLogP1.59
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.59
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-tert-butylsulfanyl-3-(1-methylbenzimidazol-2-yl)propan-2-yl]hydrazine
CID 105226520
2-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-1-amine
CID 83976139
2-(1-methylbenzimidazol-2-yl)-N-(pyridin-4-ylmethyl)ethanamine
CID 83961969
1-(1-methylbenzimidazol-2-yl)pentane-2,3-diol
CID 103454668
N,4-dimethyl-1-(1-methylbenzimidazol-2-yl)pentan-2-amine
CID 79754110
1-(1-methylbenzimidazol-2-yl)-3-phenylpropan-2-ol
CID 79753827
2-amino-3-(1-methylbenzimidazol-2-yl)propan-1-ol;hydrochloride
CID 170893125
1-(1-methylbenzimidazol-2-yl)-N-propylbutan-2-amine
CID 79754187
N,5-dimethyl-1-(1-methylbenzimidazol-2-yl)hexan-2-amine
CID 79750546
1,1-diethoxy-3-(1-methylbenzimidazol-2-yl)propan-2-ol
CID 79753376
N,4,4-trimethyl-1-(1-methylbenzimidazol-2-yl)pentan-2-amine
CID 79750625
[1-(2-iodophenyl)-2-(1-methylbenzimidazol-2-yl)ethyl]hydrazine
CID 105321049

Frequently Asked Questions

What is the IUPAC name of [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine?
The IUPAC name of [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine (CID 105212470) is [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine is Cn1c(CC(Cc2ccncc2)NN)nc2ccccc21.
What is the InChIKey of [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine?
The InChIKey is PGXHNSQLQHJNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5/c1-21-15-5-3-2-4-14(15)19-16(21)11-13(20-17)10-12-6-8-18-9-7-12/h2-9,13,20H,10-11,17H2,1H3.
What are the key properties of [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine?
[1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine has a molecular weight of 281.36 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylpropan-2-yl]hydrazine is sourced from PubChem (CID 105212470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).