4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide

C12H24N4O — CID 152848652

IUPAC4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide
SMILESCN1CCN(C2CCC(C(=O)NN)CC2)CC1
InChIInChI=1S/C12H24N4O/c1-15-6-8-16(9-7-15)11-4-2-10(3-5-11)12(17)14-13/h10-11H,2-9,13H2,1H3,(H,14,17)
InChIKeyQWBAWCMTTXCDNQ-UHFFFAOYSA-N
MW240.35 g/mol
LogP-0.22
Rot. Bonds2

About 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide

4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide (PubChem CID 152848652) has the molecular formula C12H24N4O and a molecular weight of 240.35 g/mol. Its IUPAC name is 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide.

Molecular Properties

Compound Name4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide
PubChem CID152848652
Molecular FormulaC12H24N4O
Molecular Weight240.35 g/mol
Exact Mass240.20
IUPAC Name4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide
SMILESCN1CCN(C2CCC(C(=O)NN)CC2)CC1
InChIInChI=1S/C12H24N4O/c1-15-6-8-16(9-7-15)11-4-2-10(3-5-11)12(17)14-13/h10-11H,2-9,13H2,1H3,(H,14,17)
InChIKeyQWBAWCMTTXCDNQ-UHFFFAOYSA-N
XLogP-0.22
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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CID 54031280
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CID 138688360
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CID 145781216
CID 145781216
CID 145781366
CID 145781366
CID 154638629
CID 154638629
CID 154638776
CID 154638776
CID 156050157
CID 156050157
CID 156050163
CID 156050163
CID 175407496
CID 175407496
CID 3298662
CID 3298662

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide?
The IUPAC name of 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide (CID 152848652) is 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide.
What is the SMILES notation for 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide?
The canonical SMILES for 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide is CN1CCN(C2CCC(C(=O)NN)CC2)CC1.
What is the InChIKey of 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide?
The InChIKey is QWBAWCMTTXCDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O/c1-15-6-8-16(9-7-15)11-4-2-10(3-5-11)12(17)14-13/h10-11H,2-9,13H2,1H3,(H,14,17).
What are the key properties of 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide?
4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide has a molecular weight of 240.35 g/mol, XLogP of -0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpiperazin-1-yl)cyclohexane-1-carbohydrazide is sourced from PubChem (CID 152848652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).