[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine

C12H26N4 — CID 105261340

IUPAC[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine
SMILESC=C(C)CC(NN)C1CN(C)CCCN1C
InChIInChI=1S/C12H26N4/c1-10(2)8-11(14-13)12-9-15(3)6-5-7-16(12)4/h11-12,14H,1,5-9,13H2,2-4H3
InChIKeyZEDOVODNFZYHLT-UHFFFAOYSA-N
MW226.37 g/mol
LogP0.42
Rot. Bonds4

About [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine

[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine (PubChem CID 105261340) has the molecular formula C12H26N4 and a molecular weight of 226.37 g/mol. Its IUPAC name is [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine.

Molecular Properties

Compound Name[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine
PubChem CID105261340
Molecular FormulaC12H26N4
Molecular Weight226.37 g/mol
Exact Mass226.22
IUPAC Name[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine
SMILESC=C(C)CC(NN)C1CN(C)CCCN1C
InChIInChI=1S/C12H26N4/c1-10(2)8-11(14-13)12-9-15(3)6-5-7-16(12)4/h11-12,14H,1,5-9,13H2,2-4H3
InChIKeyZEDOVODNFZYHLT-UHFFFAOYSA-N
XLogP0.42
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.37
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;5-methyl-2,4,6,7,8,8a-hexahydro-1H-pyrazolo[4,3-c]azepine
CID 177181516
1-(1,4-Dimethyl-1,4-diazepan-2-yl)-3-methylidenepentan-1-amine
CID 81822231
1-(1,4-Dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-en-1-amine
CID 81822456
1-(1,4-dimethyl-1,4-diazepan-2-yl)-N-ethyl-3-methylbut-3-en-1-amine
CID 81822808
1-(1,4-dimethyl-1,4-diazepan-2-yl)-N,3-dimethylbut-3-en-1-amine
CID 81822822
1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methyl-N-propylbut-3-en-1-amine
CID 81822906
N,N-diethyl-3-hydrazinyl-2,5-dimethylhex-5-en-2-amine
CID 105239399
[4-(Azepan-1-yl)-4-methylpent-1-en-3-yl]hydrazine
CID 105240272
[2-(Azepan-1-yl)-2,6-dimethylhept-6-en-3-yl]hydrazine
CID 105240318
[2-(Azepan-1-yl)-2-methylhept-6-en-3-yl]hydrazine
CID 105240330
[2-(Azepan-1-yl)-2-methylhex-5-en-3-yl]hydrazine
CID 105240367
[2-(Azepan-1-yl)-2,5-dimethylhex-5-en-3-yl]hydrazine
CID 105240401

Frequently Asked Questions

What is the IUPAC name of [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine?
The IUPAC name of [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine (CID 105261340) is [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine.
What is the SMILES notation for [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine?
The canonical SMILES for [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine is C=C(C)CC(NN)C1CN(C)CCCN1C.
What is the InChIKey of [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine?
The InChIKey is ZEDOVODNFZYHLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4/c1-10(2)8-11(14-13)12-9-15(3)6-5-7-16(12)4/h11-12,14H,1,5-9,13H2,2-4H3.
What are the key properties of [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine?
[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine has a molecular weight of 226.37 g/mol, XLogP of 0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylbut-3-enyl]hydrazine is sourced from PubChem (CID 105261340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).