1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide

C15H22N4O2 — CID 63568830

IUPAC1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide
SMILESCN(CC(=O)N1CCC(C(=O)NN)CC1)c1ccccc1
InChIInChI=1S/C15H22N4O2/c1-18(13-5-3-2-4-6-13)11-14(20)19-9-7-12(8-10-19)15(21)17-16/h2-6,12H,7-11,16H2,1H3,(H,17,21)
InChIKeyWOZKUUITJFBIIA-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.35
Rot. Bonds4

About 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide

1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide (PubChem CID 63568830) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide.

Molecular Properties

Compound Name1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide
PubChem CID63568830
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide
SMILESCN(CC(=O)N1CCC(C(=O)NN)CC1)c1ccccc1
InChIInChI=1S/C15H22N4O2/c1-18(13-5-3-2-4-6-13)11-14(20)19-9-7-12(8-10-19)15(21)17-16/h2-6,12H,7-11,16H2,1H3,(H,17,21)
InChIKeyWOZKUUITJFBIIA-UHFFFAOYSA-N
XLogP0.35
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.35
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

1-(4-benzylpiperidin-1-yl)-2-(N-methylanilino)ethanone
CID 23294466
1-(3-phenylpropanoyl)piperidine-4-carbohydrazide
CID 54794050
2-[[2-[4-(hydrazinecarbonyl)piperidin-1-yl]-2-oxoethyl]-methylamino]acetamide
CID 63574037
1-[2-(4-fluoro-N-methylanilino)acetyl]piperidine-4-carboxylic acid
CID 62657443
1-[2-[2-hydroxyethyl(methyl)amino]acetyl]piperidine-4-carbohydrazide
CID 63573012
ethyl 1-[2-(N-methylanilino)acetyl]piperidine-3-carboxylate
CID 78782540
1-(3-cyclohexylpyrrolidin-1-yl)-2-(N-methylanilino)ethanone
CID 154783657
1-[(3S,4R)-3-amino-4-propylpyrrolidin-1-yl]-2-(N-methylanilino)ethanone
CID 133133321
1-[2-(N,2-dimethylanilino)acetyl]piperidine-4-carboxylic acid
CID 62657444
1-[2-[ethyl(propan-2-yl)amino]acetyl]piperidine-4-carbohydrazide
CID 63574205
1-(2-pyrazol-1-ylacetyl)piperidine-4-carbohydrazide
CID 63573929
2-(N-methylanilino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 47145142

Frequently Asked Questions

What is the IUPAC name of 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide?
The IUPAC name of 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide (CID 63568830) is 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide.
What is the SMILES notation for 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide?
The canonical SMILES for 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide is CN(CC(=O)N1CCC(C(=O)NN)CC1)c1ccccc1.
What is the InChIKey of 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide?
The InChIKey is WOZKUUITJFBIIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-18(13-5-3-2-4-6-13)11-14(20)19-9-7-12(8-10-19)15(21)17-16/h2-6,12H,7-11,16H2,1H3,(H,17,21).
What are the key properties of 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide?
1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide has a molecular weight of 290.37 g/mol, XLogP of 0.35, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(N-methylanilino)acetyl]piperidine-4-carbohydrazide is sourced from PubChem (CID 63568830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).