1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one

C10H20N2O — CID 129162708

IUPAC1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one
SMILESCNNC1CCC(CC(C)=O)CC1
InChIInChI=1S/C10H20N2O/c1-8(13)7-9-3-5-10(6-4-9)12-11-2/h9-12H,3-7H2,1-2H3
InChIKeyHJPBPMLLEGFAKV-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.25
Rot. Bonds4

About 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one

1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one (PubChem CID 129162708) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one.

Molecular Properties

Compound Name1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one
PubChem CID129162708
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one
SMILESCNNC1CCC(CC(C)=O)CC1
InChIInChI=1S/C10H20N2O/c1-8(13)7-9-3-5-10(6-4-9)12-11-2/h9-12H,3-7H2,1-2H3
InChIKeyHJPBPMLLEGFAKV-UHFFFAOYSA-N
XLogP1.25
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one?
The IUPAC name of 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one (CID 129162708) is 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one.
What is the SMILES notation for 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one?
The canonical SMILES for 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one is CNNC1CCC(CC(C)=O)CC1.
What is the InChIKey of 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one?
The InChIKey is HJPBPMLLEGFAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(13)7-9-3-5-10(6-4-9)12-11-2/h9-12H,3-7H2,1-2H3.
What are the key properties of 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one?
1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one has a molecular weight of 184.28 g/mol, XLogP of 1.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methylhydrazinyl)cyclohexyl]propan-2-one is sourced from PubChem (CID 129162708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).