[(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine

C13H24N4S — CID 105261282

IUPAC[(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine
SMILESCc1ccsc1C(NN)C1CN(C)CCCN1C
InChIInChI=1S/C13H24N4S/c1-10-5-8-18-13(10)12(15-14)11-9-16(2)6-4-7-17(11)3/h5,8,11-12,15H,4,6-7,9,14H2,1-3H3
InChIKeySIEPUURFZPAHPR-UHFFFAOYSA-N
MW268.43 g/mol
LogP1.20
Rot. Bonds3

About [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine

[(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine (PubChem CID 105261282) has the molecular formula C13H24N4S and a molecular weight of 268.43 g/mol. Its IUPAC name is [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine
PubChem CID105261282
Molecular FormulaC13H24N4S
Molecular Weight268.43 g/mol
Exact Mass268.17
IUPAC Name[(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine
SMILESCc1ccsc1C(NN)C1CN(C)CCCN1C
InChIInChI=1S/C13H24N4S/c1-10-5-8-18-13(10)12(15-14)11-9-16(2)6-4-7-17(11)3/h5,8,11-12,15H,4,6-7,9,14H2,1-3H3
InChIKeySIEPUURFZPAHPR-UHFFFAOYSA-N
XLogP1.20
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 51.20
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

[(1,4-dimethyl-1,4-diazepan-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105261347
N-[(3-chlorothiophen-2-yl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]ethanamine
CID 107360102
[(1,4-dimethyl-1,4-diazepan-2-yl)-(4-fluorophenyl)methyl]hydrazine
CID 105261273
[(4-chlorophenyl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261246
[(4-bromothiophen-3-yl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261189
N-[(1,4-dimethyl-1,4-diazepan-2-yl)-(2-methylthiophen-3-yl)methyl]ethanamine
CID 102833635
[(1,4-dimethylpiperazin-2-yl)-(4-methylphenyl)methyl]hydrazine
CID 105247203
[(1,4-dimethyl-1,4-diazepan-2-yl)-pyrimidin-5-ylmethyl]hydrazine
CID 105261200
[(1,4-dimethyl-1,4-diazepan-2-yl)-(4-propylphenyl)methyl]hydrazine
CID 105261179
[(1,4-dimethyl-1,4-diazepan-2-yl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105261259
[(5-bromo-2-fluorophenyl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261300
3-[(1,4-dimethyl-1,4-diazepan-2-yl)-hydrazinylmethyl]-5-methylpyridin-2-amine
CID 105261374

Frequently Asked Questions

What is the IUPAC name of [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine (CID 105261282) is [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine is Cc1ccsc1C(NN)C1CN(C)CCCN1C.
What is the InChIKey of [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The InChIKey is SIEPUURFZPAHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4S/c1-10-5-8-18-13(10)12(15-14)11-9-16(2)6-4-7-17(11)3/h5,8,11-12,15H,4,6-7,9,14H2,1-3H3.
What are the key properties of [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine?
[(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine has a molecular weight of 268.43 g/mol, XLogP of 1.20, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(1,4-dimethyl-1,4-diazepan-2-yl)-(3-methylthiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105261282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).