1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine

C19H36N2 — CID 170229998

IUPAC1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine
SMILESCCCC(C)(C)C(CNNC1CC1)/C1=C/CCCCCC1
InChIInChI=1S/C19H36N2/c1-4-14-19(2,3)18(15-20-21-17-12-13-17)16-10-8-6-5-7-9-11-16/h10,17-18,20-21H,4-9,11-15H2,1-3H3/b16-10+
InChIKeyPPWNHUVKIGURAM-MHWRWJLKSA-N
MW292.51 g/mol
LogP4.97
Rot. Bonds8

About 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine

1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine (PubChem CID 170229998) has the molecular formula C19H36N2 and a molecular weight of 292.51 g/mol. Its IUPAC name is 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine.

Molecular Properties

Compound Name1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine
PubChem CID170229998
Molecular FormulaC19H36N2
Molecular Weight292.51 g/mol
Exact Mass292.29
IUPAC Name1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine
SMILESCCCC(C)(C)C(CNNC1CC1)/C1=C/CCCCCC1
InChIInChI=1S/C19H36N2/c1-4-14-19(2,3)18(15-20-21-17-12-13-17)16-10-8-6-5-7-9-11-16/h10,17-18,20-21H,4-9,11-15H2,1-3H3/b16-10+
InChIKeyPPWNHUVKIGURAM-MHWRWJLKSA-N
XLogP4.97
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.51
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine?
The IUPAC name of 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine (CID 170229998) is 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine.
What is the SMILES notation for 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine?
The canonical SMILES for 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine is CCCC(C)(C)C(CNNC1CC1)/C1=C/CCCCCC1.
What is the InChIKey of 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine?
The InChIKey is PPWNHUVKIGURAM-MHWRWJLKSA-N. The full InChI is InChI=1S/C19H36N2/c1-4-14-19(2,3)18(15-20-21-17-12-13-17)16-10-8-6-5-7-9-11-16/h10,17-18,20-21H,4-9,11-15H2,1-3H3/b16-10+.
What are the key properties of 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine?
1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine has a molecular weight of 292.51 g/mol, XLogP of 4.97, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(1Z)-cycloocten-1-yl]-3,3-dimethylhexyl]-2-cyclopropylhydrazine is sourced from PubChem (CID 170229998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).