[3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine

C15H31N3 — CID 105240360

IUPAC[3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine
SMILESCC(C)(C(CC1CCC1)NN)N1CCCCCC1
InChIInChI=1S/C15H31N3/c1-15(2,18-10-5-3-4-6-11-18)14(17-16)12-13-8-7-9-13/h13-14,17H,3-12,16H2,1-2H3
InChIKeyLFDTVJHWCFGCHQ-UHFFFAOYSA-N
MW253.43 g/mol
LogP2.66
Rot. Bonds5

About [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine

[3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine (PubChem CID 105240360) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine
PubChem CID105240360
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name[3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine
SMILESCC(C)(C(CC1CCC1)NN)N1CCCCCC1
InChIInChI=1S/C15H31N3/c1-15(2,18-10-5-3-4-6-11-18)14(17-16)12-13-8-7-9-13/h13-14,17H,3-12,16H2,1-2H3
InChIKeyLFDTVJHWCFGCHQ-UHFFFAOYSA-N
XLogP2.66
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-cyclopropyl-3-methyl-3-piperidin-1-ylbutan-2-yl)hydrazine
CID 105239761
3-(azepan-1-yl)-1-cyclobutyl-N,3-dimethylbutan-2-amine
CID 79050954
1-cyclopentyl-N,3-dimethyl-3-piperidin-1-ylbutan-2-amine
CID 79045410
(1-cyclohexyl-3-methyl-3-piperidin-1-ylpentan-2-yl)hydrazine
CID 105241297
1-cyclopentyl-N-ethyl-3-methyl-3-pyrrolidin-1-ylbutan-2-amine
CID 79056065
1-cyclobutyl-3-methyl-3-pyrrolidin-1-ylbutan-2-amine
CID 79055721
3-(azepan-1-yl)-1-cyclopropyl-3-methyl-N-propylbutan-2-amine
CID 79051842
[2-(azepan-1-yl)-1-cyclobutyl-2-methylpropyl]hydrazine
CID 105240404
1-cyclopropyl-3-methyl-3-piperidin-1-ylbutan-2-ol
CID 79044925
N,3-dimethyl-1-(oxan-4-yl)-3-pyrrolidin-1-ylbutan-2-amine
CID 79055647
N-ethyl-3-methyl-1-(oxan-4-yl)-3-pyrrolidin-1-ylbutan-2-amine
CID 79056741
(1-cyclobutyl-3-methyl-3-morpholin-4-ylpentan-2-yl)hydrazine
CID 105241536

Frequently Asked Questions

What is the IUPAC name of [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine?
The IUPAC name of [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine (CID 105240360) is [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine.
What is the SMILES notation for [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine?
The canonical SMILES for [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine is CC(C)(C(CC1CCC1)NN)N1CCCCCC1.
What is the InChIKey of [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine?
The InChIKey is LFDTVJHWCFGCHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-15(2,18-10-5-3-4-6-11-18)14(17-16)12-13-8-7-9-13/h13-14,17H,3-12,16H2,1-2H3.
What are the key properties of [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine?
[3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine has a molecular weight of 253.43 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(azepan-1-yl)-1-cyclobutyl-3-methylbutan-2-yl]hydrazine is sourced from PubChem (CID 105240360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).