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

C13H28N4 — CID 105261344

IUPAC[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine
SMILESC=C(CC)CC(NN)C1CN(C)CCCN1C
InChIInChI=1S/C13H28N4/c1-5-11(2)9-12(15-14)13-10-16(3)7-6-8-17(13)4/h12-13,15H,2,5-10,14H2,1,3-4H3
InChIKeyIEWRDBBFCGGPQM-UHFFFAOYSA-N
MW240.39 g/mol
LogP0.81
Rot. Bonds5

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

[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine (PubChem CID 105261344) has the molecular formula C13H28N4 and a molecular weight of 240.39 g/mol. Its IUPAC name is [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine.

Molecular Properties

Compound Name[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine
PubChem CID105261344
Molecular FormulaC13H28N4
Molecular Weight240.39 g/mol
Exact Mass240.23
IUPAC Name[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine
SMILESC=C(CC)CC(NN)C1CN(C)CCCN1C
InChIInChI=1S/C13H28N4/c1-5-11(2)9-12(15-14)13-10-16(3)7-6-8-17(13)4/h12-13,15H,2,5-10,14H2,1,3-4H3
InChIKeyIEWRDBBFCGGPQM-UHFFFAOYSA-N
XLogP0.81
TPSA44.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 50.81
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'}

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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-methyl-3-methylidenepentan-1-amine
CID 81822826
1-(1,4-dimethyl-1,4-diazepan-2-yl)-N-ethyl-3-methylidenepentan-1-amine
CID 81822903
[2-(Azepan-1-yl)-2-methyloct-7-en-3-yl]hydrazine
CID 105240270
[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
[2-(Azepan-1-yl)-2-methyl-5-methylideneheptan-3-yl]hydrazine
CID 105240406

Frequently Asked Questions

What is the IUPAC name of [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine?
The IUPAC name of [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine (CID 105261344) is [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine.
What is the SMILES notation for [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine?
The canonical SMILES for [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine is C=C(CC)CC(NN)C1CN(C)CCCN1C.
What is the InChIKey of [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine?
The InChIKey is IEWRDBBFCGGPQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4/c1-5-11(2)9-12(15-14)13-10-16(3)7-6-8-17(13)4/h12-13,15H,2,5-10,14H2,1,3-4H3.
What are the key properties of [1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine?
[1-(1,4-dimethyl-1,4-diazepan-2-yl)-3-methylidenepentyl]hydrazine has a molecular weight of 240.39 g/mol, XLogP of 0.81, 5 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-methylidenepentyl]hydrazine is sourced from PubChem (CID 105261344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).