[1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine

C18H37N3 — CID 105242205

IUPAC[1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine
SMILESCCC(CC)(C(NN)C1CCC(C)C(C)C1)N1CCCC1
InChIInChI=1S/C18H37N3/c1-5-18(6-2,21-11-7-8-12-21)17(20-19)16-10-9-14(3)15(4)13-16/h14-17,20H,5-13,19H2,1-4H3
InChIKeyOEKDSZCUMSEKTP-UHFFFAOYSA-N
MW295.51 g/mol
LogP3.55
Rot. Bonds6

About [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine

[1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine (PubChem CID 105242205) has the molecular formula C18H37N3 and a molecular weight of 295.51 g/mol. Its IUPAC name is [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine
PubChem CID105242205
Molecular FormulaC18H37N3
Molecular Weight295.51 g/mol
Exact Mass295.30
IUPAC Name[1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine
SMILESCCC(CC)(C(NN)C1CCC(C)C(C)C1)N1CCCC1
InChIInChI=1S/C18H37N3/c1-5-18(6-2,21-11-7-8-12-21)17(20-19)16-10-9-14(3)15(4)13-16/h14-17,20H,5-13,19H2,1-4H3
InChIKeyOEKDSZCUMSEKTP-UHFFFAOYSA-N
XLogP3.55
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.51
LogP ≤ 53.55
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-cyclopentyl-2-ethyl-2-pyrrolidin-1-ylbutyl)hydrazine
CID 105242115
[2-ethyl-1-(oxan-3-yl)-2-pyrrolidin-1-ylbutyl]hydrazine
CID 107139611
N,2-diethyl-1-(3-methylcyclohexyl)-2-pyrrolidin-1-ylbutan-1-amine
CID 79057396
[2-methyl-1-(3-methylcyclohexyl)-2-pyrrolidin-1-ylbutyl]hydrazine
CID 105241067
(1-cyclopentyl-2-methyl-2-pyrrolidin-1-ylbutyl)hydrazine
CID 105241054
(4-ethyl-2,2-dimethyl-4-pyrrolidin-1-ylhexan-3-yl)hydrazine
CID 105242234
[2-methyl-1-(3-methylcyclohexyl)-2-piperidin-1-ylpropyl]hydrazine
CID 105239825
[2-(azepan-1-yl)-1-cyclobutyl-2-methylpropyl]hydrazine
CID 105240404
1-cyclobutyl-3-ethyl-N-methyl-3-pyrrolidin-1-ylpentan-2-amine
CID 79067520
[cyclopropyl-(3,4-dimethylcyclohexyl)methyl]hydrazine
CID 105202513
[cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine
CID 105224480
1-(3,4-dimethylcyclohexyl)-N,2-diethyl-2-methoxybutan-1-amine
CID 116761248

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine?
The IUPAC name of [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine (CID 105242205) is [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine.
What is the SMILES notation for [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine?
The canonical SMILES for [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine is CCC(CC)(C(NN)C1CCC(C)C(C)C1)N1CCCC1.
What is the InChIKey of [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine?
The InChIKey is OEKDSZCUMSEKTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37N3/c1-5-18(6-2,21-11-7-8-12-21)17(20-19)16-10-9-14(3)15(4)13-16/h14-17,20H,5-13,19H2,1-4H3.
What are the key properties of [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine?
[1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine has a molecular weight of 295.51 g/mol, XLogP of 3.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dimethylcyclohexyl)-2-ethyl-2-pyrrolidin-1-ylbutyl]hydrazine is sourced from PubChem (CID 105242205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).