3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide

C16H26N4O2 — CID 7780052

IUPAC3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide
SMILESCc1cc(C)n(CC(=O)NNC(=O)CCC2CCCCC2)n1
InChIInChI=1S/C16H26N4O2/c1-12-10-13(2)20(19-12)11-16(22)18-17-15(21)9-8-14-6-4-3-5-7-14/h10,14H,3-9,11H2,1-2H3,(H,17,21)(H,18,22)
InChIKeyXDKMZAUIQPUFJO-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.01
Rot. Bonds5

About 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide

3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide (PubChem CID 7780052) has the molecular formula C16H26N4O2 and a molecular weight of 306.41 g/mol. Its IUPAC name is 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide.

Molecular Properties

Compound Name3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide
PubChem CID7780052
Molecular FormulaC16H26N4O2
Molecular Weight306.41 g/mol
Exact Mass306.21
IUPAC Name3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide
SMILESCc1cc(C)n(CC(=O)NNC(=O)CCC2CCCCC2)n1
InChIInChI=1S/C16H26N4O2/c1-12-10-13(2)20(19-12)11-16(22)18-17-15(21)9-8-14-6-4-3-5-7-14/h10,14H,3-9,11H2,1-2H3,(H,17,21)(H,18,22)
InChIKeyXDKMZAUIQPUFJO-UHFFFAOYSA-N
XLogP2.01
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-cyclohexyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]propanamide
CID 47005374
N-(cyclopropylmethyl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
CID 55028096
N-[3-[2-[2-(3,5-dimethylpyrazol-1-yl)acetyl]hydrazinyl]-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 46437776
2-[(1R)-cyclopent-2-en-1-yl]-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]acetohydrazide
CID 9424979
3-cyclopentyl-N-(2,5-dimethylpyrazol-3-yl)propanamide
CID 35291168
3-(4-chlorophenyl)-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide
CID 34390205
2-(3,5-dimethylpyrazol-1-yl)-N-propan-2-ylacetamide
CID 19525814
4-tert-butyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]benzohydrazide
CID 9416710
2-(3,5-dimethylpyrazol-1-yl)-N-[(1-hydroxy-4-methylcyclohexyl)methyl]acetamide
CID 65119104
1-[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]-3-ethylthiourea
CID 4290547
N-(azetidin-3-yl)-2-(3,5-dimethylpyrazol-1-yl)acetamide
CID 66185586
N-(cycloheptylideneamino)-2-(3,5-dimethylpyrazol-1-yl)acetamide
CID 4854182

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide?
The IUPAC name of 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide (CID 7780052) is 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide.
What is the SMILES notation for 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide?
The canonical SMILES for 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide is Cc1cc(C)n(CC(=O)NNC(=O)CCC2CCCCC2)n1.
What is the InChIKey of 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide?
The InChIKey is XDKMZAUIQPUFJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O2/c1-12-10-13(2)20(19-12)11-16(22)18-17-15(21)9-8-14-6-4-3-5-7-14/h10,14H,3-9,11H2,1-2H3,(H,17,21)(H,18,22).
What are the key properties of 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide?
3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide has a molecular weight of 306.41 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]propanehydrazide is sourced from PubChem (CID 7780052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).