[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine

C12H24N6 — CID 105261259

IUPAC[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
SMILESCN1CCCN(C)C(C(NN)c2nccn2C)C1
InChIInChI=1S/C12H24N6/c1-16-6-4-7-17(2)10(9-16)11(15-13)12-14-5-8-18(12)3/h5,8,10-11,15H,4,6-7,9,13H2,1-3H3
InChIKeySLOZMNXDQGCDNN-UHFFFAOYSA-N
MW252.37 g/mol
LogP-0.44
Rot. Bonds3

About [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine

[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine (PubChem CID 105261259) has the molecular formula C12H24N6 and a molecular weight of 252.37 g/mol. Its IUPAC name is [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
PubChem CID105261259
Molecular FormulaC12H24N6
Molecular Weight252.37 g/mol
Exact Mass252.21
IUPAC Name[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
SMILESCN1CCCN(C)C(C(NN)c2nccn2C)C1
InChIInChI=1S/C12H24N6/c1-16-6-4-7-17(2)10(9-16)11(15-13)12-14-5-8-18(12)3/h5,8,10-11,15H,4,6-7,9,13H2,1-3H3
InChIKeySLOZMNXDQGCDNN-UHFFFAOYSA-N
XLogP-0.44
TPSA62.35 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.37
LogP ≤ 5-0.44
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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Frequently Asked Questions

What is the IUPAC name of [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The IUPAC name of [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine (CID 105261259) is [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine.
What is the SMILES notation for [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The canonical SMILES for [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine is CN1CCCN(C)C(C(NN)c2nccn2C)C1.
What is the InChIKey of [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine?
The InChIKey is SLOZMNXDQGCDNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N6/c1-16-6-4-7-17(2)10(9-16)11(15-13)12-14-5-8-18(12)3/h5,8,10-11,15H,4,6-7,9,13H2,1-3H3.
What are the key properties of [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine?
[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine has a molecular weight of 252.37 g/mol, XLogP of -0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine is sourced from PubChem (CID 105261259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).