[1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine

C19H34N2 — CID 105310162

IUPAC[1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine
SMILESCC12CC3CC(C)(C1)CC(CC(CC1CCC1)NN)(C3)C2
InChIInChI=1S/C19H34N2/c1-17-7-15-8-18(2,11-17)13-19(9-15,12-17)10-16(21-20)6-14-4-3-5-14/h14-16,21H,3-13,20H2,1-2H3
InChIKeyZYXVTPWOZBMDSE-UHFFFAOYSA-N
MW290.50 g/mol
LogP4.40
Rot. Bonds5

About [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine

[1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine (PubChem CID 105310162) has the molecular formula C19H34N2 and a molecular weight of 290.50 g/mol. Its IUPAC name is [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine
PubChem CID105310162
Molecular FormulaC19H34N2
Molecular Weight290.50 g/mol
Exact Mass290.27
IUPAC Name[1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine
SMILESCC12CC3CC(C)(C1)CC(CC(CC1CCC1)NN)(C3)C2
InChIInChI=1S/C19H34N2/c1-17-7-15-8-18(2,11-17)13-19(9-15,12-17)10-16(21-20)6-14-4-3-5-14/h14-16,21H,3-13,20H2,1-2H3
InChIKeyZYXVTPWOZBMDSE-UHFFFAOYSA-N
XLogP4.40
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.50
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(3,5-dimethyl-1-adamantyl)-3-ethoxypropan-2-yl]hydrazine
CID 105321310
[1-(3,5-dimethyl-1-adamantyl)-3-methylbutan-2-yl]hydrazine
CID 105281772
1-(3,5-dimethyl-1-adamantyl)-N-propylpentan-2-amine
CID 114981869
2-(3,5-dimethyl-1-adamantyl)-1-(oxolan-3-yl)ethanol
CID 115798125
1-(3,5-dimethyl-1-adamantyl)-N-methylhex-4-yn-2-amine
CID 115819782
1-(3,5-dimethyl-1-adamantyl)-3,3-dimethylbutan-2-ol
CID 115796460
2-cyclohexyl-1-(3,5-dimethyl-1-adamantyl)ethanol
CID 79995433
1,3-dicyclohexylpropan-2-ylhydrazine
CID 105296165
1-(3,5-dimethyl-1-adamantyl)-3-ethoxypropan-2-amine
CID 105007902
1-(cyclopenten-1-yl)-2-(3,5-dimethyl-1-adamantyl)ethanamine
CID 79988542
1-(3,5-dimethyl-1-adamantyl)-N-ethyl-3-methylpentan-2-amine
CID 105017513
2-(3,5-dimethyl-1-adamantyl)-1-phenylethanamine
CID 79987752

Frequently Asked Questions

What is the IUPAC name of [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine?
The IUPAC name of [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine (CID 105310162) is [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine is CC12CC3CC(C)(C1)CC(CC(CC1CCC1)NN)(C3)C2.
What is the InChIKey of [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine?
The InChIKey is ZYXVTPWOZBMDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2/c1-17-7-15-8-18(2,11-17)13-19(9-15,12-17)10-16(21-20)6-14-4-3-5-14/h14-16,21H,3-13,20H2,1-2H3.
What are the key properties of [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine?
[1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine has a molecular weight of 290.50 g/mol, XLogP of 4.40, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105310162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).