[(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine

C11H22N2 — CID 89163836

IUPAC[(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine
SMILESCC(C)C(=C1CC1)[C@@H](NN)C(C)C
InChIInChI=1S/C11H22N2/c1-7(2)10(9-5-6-9)11(13-12)8(3)4/h7-8,11,13H,5-6,12H2,1-4H3/t11-/m0/s1
InChIKeyXVBRBRGKGRITSD-NSHDSACASA-N
MW182.31 g/mol
LogP2.22
Rot. Bonds4

About [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine

[(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine (PubChem CID 89163836) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine.

Molecular Properties

Compound Name[(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine
PubChem CID89163836
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name[(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine
SMILESCC(C)C(=C1CC1)[C@@H](NN)C(C)C
InChIInChI=1S/C11H22N2/c1-7(2)10(9-5-6-9)11(13-12)8(3)4/h7-8,11,13H,5-6,12H2,1-4H3/t11-/m0/s1
InChIKeyXVBRBRGKGRITSD-NSHDSACASA-N
XLogP2.22
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine?
The IUPAC name of [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine (CID 89163836) is [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine.
What is the SMILES notation for [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine?
The canonical SMILES for [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine is CC(C)C(=C1CC1)[C@@H](NN)C(C)C.
What is the InChIKey of [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine?
The InChIKey is XVBRBRGKGRITSD-NSHDSACASA-N. The full InChI is InChI=1S/C11H22N2/c1-7(2)10(9-5-6-9)11(13-12)8(3)4/h7-8,11,13H,5-6,12H2,1-4H3/t11-/m0/s1.
What are the key properties of [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine?
[(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine has a molecular weight of 182.31 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3S)-4-cyclopropylidene-2,5-dimethylhexan-3-yl]hydrazine is sourced from PubChem (CID 89163836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).