1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide

C12H19N5O2 — CID 55213875

IUPAC1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide
SMILESCc1cnn(CC(=O)N2CCC(C(=O)NN)CC2)c1
InChIInChI=1S/C12H19N5O2/c1-9-6-14-17(7-9)8-11(18)16-4-2-10(3-5-16)12(19)15-13/h6-7,10H,2-5,8,13H2,1H3,(H,15,19)
InChIKeyDZXPKQXIWOHAEF-UHFFFAOYSA-N
MW265.32 g/mol
LogP-0.58
Rot. Bonds3

About 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide

1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide (PubChem CID 55213875) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide
PubChem CID55213875
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide
SMILESCc1cnn(CC(=O)N2CCC(C(=O)NN)CC2)c1
InChIInChI=1S/C12H19N5O2/c1-9-6-14-17(7-9)8-11(18)16-4-2-10(3-5-16)12(19)15-13/h6-7,10H,2-5,8,13H2,1H3,(H,15,19)
InChIKeyDZXPKQXIWOHAEF-UHFFFAOYSA-N
XLogP-0.58
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide
CID 63573929
ethyl 1-[2-(4-aminopyrazol-1-yl)acetyl]piperidine-4-carboxylate
CID 61118509
1-(3-hydroxyazetidin-1-yl)-2-(4-methylpyrazol-1-yl)ethanone
CID 156799354
1-[2-(5-methylpyrimidin-2-yl)sulfanylacetyl]piperidine-4-carbohydrazide
CID 63590293
2-(4-methylpyrazol-1-yl)-1-[4-[4-methyl-5-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-3-yl]piperidin-1-yl]ethanone
CID 70731934
1-[4-(1-hydroxy-2-phenylethyl)piperidin-1-yl]-2-(4-methylpyrazol-1-yl)ethanone
CID 70767388
1-[2-(4-chloro-3,5-dimethylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide
CID 63577626
1-[(4S,5S)-4-hydroxy-5-[methyl(oxan-4-yl)amino]azepan-1-yl]-2-(4-methylpyrazol-1-yl)ethanone
CID 110128457
1-[2-(3,5-dimethylphenoxy)acetyl]piperidine-4-carbohydrazide
CID 54794164
1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide
CID 63568830
1-[(3R)-3-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-(4-methylpyrazol-1-yl)ethanone
CID 124996250
2-(4-methylpyrazol-1-yl)-1-[4-[4-methyl-5-(1,2,4-triazol-1-ylmethyl)-1,2,4-triazol-3-yl]piperidin-1-yl]ethanone
CID 72872754

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide (CID 55213875) is 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide is Cc1cnn(CC(=O)N2CCC(C(=O)NN)CC2)c1.
What is the InChIKey of 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide?
The InChIKey is DZXPKQXIWOHAEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-9-6-14-17(7-9)8-11(18)16-4-2-10(3-5-16)12(19)15-13/h6-7,10H,2-5,8,13H2,1H3,(H,15,19).
What are the key properties of 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide?
1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide has a molecular weight of 265.32 g/mol, XLogP of -0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methylpyrazol-1-yl)acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 55213875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).