4-(4-cyclohexylpiperazin-1-yl)benzohydrazide

C17H26N4O — CID 20655195

IUPAC4-(4-cyclohexylpiperazin-1-yl)benzohydrazide
SMILESNNC(=O)c1ccc(N2CCN(C3CCCCC3)CC2)cc1
InChIInChI=1S/C17H26N4O/c18-19-17(22)14-6-8-16(9-7-14)21-12-10-20(11-13-21)15-4-2-1-3-5-15/h6-9,15H,1-5,10-13,18H2,(H,19,22)
InChIKeyWWOZFVQWHNNWKI-UHFFFAOYSA-N
MW302.42 g/mol
LogP1.74
Rot. Bonds3

About 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide

4-(4-cyclohexylpiperazin-1-yl)benzohydrazide (PubChem CID 20655195) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide.

Molecular Properties

Compound Name4-(4-cyclohexylpiperazin-1-yl)benzohydrazide
PubChem CID20655195
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC Name4-(4-cyclohexylpiperazin-1-yl)benzohydrazide
SMILESNNC(=O)c1ccc(N2CCN(C3CCCCC3)CC2)cc1
InChIInChI=1S/C17H26N4O/c18-19-17(22)14-6-8-16(9-7-14)21-12-10-20(11-13-21)15-4-2-1-3-5-15/h6-9,15H,1-5,10-13,18H2,(H,19,22)
InChIKeyWWOZFVQWHNNWKI-UHFFFAOYSA-N
XLogP1.74
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 51.74
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'}

Analyze 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[4-(4-cyclopentylpiperazin-1-yl)phenyl]ethanone
CID 10149338
4-pyrrolidin-1-ylbenzohydrazide;hydrochloride
CID 163230065
N-[4-(4-cyclopentylpiperazin-1-yl)phenyl]pyridine-4-carboxamide
CID 112502757
4-(4-cyclopropyl-1,4-diazepan-1-yl)benzoic acid
CID 69089179
1-cyclohexyl-4-(4-methylphenyl)piperazine
CID 20655127
N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]-2-methylpropanamide
CID 112502772
1-cycloheptyl-4-phenylpiperazine
CID 2846720
N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]formamide
CID 58958425
4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)benzoic acid
CID 79934834
ethyl 2-[4-(4-cyclopentylpiperazin-1-yl)anilino]-2-oxoacetate
CID 112502760
N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]oxolane-2-carboxamide
CID 112502775
N-[(3R)-1-cycloheptylpiperidin-3-yl]-4-morpholin-4-ylbenzamide
CID 42098695

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide?
The IUPAC name of 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide (CID 20655195) is 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide.
What is the SMILES notation for 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide?
The canonical SMILES for 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide is NNC(=O)c1ccc(N2CCN(C3CCCCC3)CC2)cc1.
What is the InChIKey of 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide?
The InChIKey is WWOZFVQWHNNWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c18-19-17(22)14-6-8-16(9-7-14)21-12-10-20(11-13-21)15-4-2-1-3-5-15/h6-9,15H,1-5,10-13,18H2,(H,19,22).
What are the key properties of 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide?
4-(4-cyclohexylpiperazin-1-yl)benzohydrazide has a molecular weight of 302.42 g/mol, XLogP of 1.74, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclohexylpiperazin-1-yl)benzohydrazide is sourced from PubChem (CID 20655195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).