4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide

C13H18N4O2 — CID 63662542

IUPAC4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide
SMILESCc1cc(C(=O)NC2CCC(=O)NC2)ccc1NN
InChIInChI=1S/C13H18N4O2/c1-8-6-9(2-4-11(8)17-14)13(19)16-10-3-5-12(18)15-7-10/h2,4,6,10,17H,3,5,7,14H2,1H3,(H,15,18)(H,16,19)
InChIKeyGKQGEYPLYDCEQM-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.29
Rot. Bonds3

About 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide

4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide (PubChem CID 63662542) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide.

Molecular Properties

Compound Name4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide
PubChem CID63662542
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC Name4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide
SMILESCc1cc(C(=O)NC2CCC(=O)NC2)ccc1NN
InChIInChI=1S/C13H18N4O2/c1-8-6-9(2-4-11(8)17-14)13(19)16-10-3-5-12(18)15-7-10/h2,4,6,10,17H,3,5,7,14H2,1H3,(H,15,18)(H,16,19)
InChIKeyGKQGEYPLYDCEQM-UHFFFAOYSA-N
XLogP0.29
TPSA96.25 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-4-methyl-N-(6-oxopiperidin-3-yl)benzamide
CID 63662752
4-chloro-3-methyl-N-(6-oxopiperidin-3-yl)benzamide
CID 113256480
3-methyl-N-(6-oxopiperidin-3-yl)benzamide
CID 62491778
3-methyl-N-(5-oxopyrrolidin-3-yl)-4-(propylamino)benzamide
CID 106197813
3-amino-4-methoxy-N-(6-oxopiperidin-3-yl)benzamide
CID 55246056
4-methyl-3-[(6-oxopiperidin-3-yl)carbamoylamino]benzoic acid
CID 63663220
4-(N'-hydroxycarbamimidoyl)-N-(6-oxopiperidin-3-yl)benzamide
CID 77004005
3-[(6-oxopiperidin-3-yl)carbamoyl]benzoic acid
CID 63662325
N-(6-oxopiperidin-3-yl)-2H-benzotriazole-5-carboxamide
CID 62489932
3-chloro-4-fluoro-N-(6-oxopiperidin-3-yl)benzamide
CID 81434409
3,6-dimethyl-2-[(6-oxopiperidin-3-yl)carbamoyl]benzoic acid
CID 103429074
3-bromo-4-methoxy-N-(6-oxopiperidin-3-yl)benzamide
CID 62492298

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide?
The IUPAC name of 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide (CID 63662542) is 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide.
What is the SMILES notation for 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide?
The canonical SMILES for 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide is Cc1cc(C(=O)NC2CCC(=O)NC2)ccc1NN.
What is the InChIKey of 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide?
The InChIKey is GKQGEYPLYDCEQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-8-6-9(2-4-11(8)17-14)13(19)16-10-3-5-12(18)15-7-10/h2,4,6,10,17H,3,5,7,14H2,1H3,(H,15,18)(H,16,19).
What are the key properties of 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide?
4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide has a molecular weight of 262.31 g/mol, XLogP of 0.29, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-3-methyl-N-(6-oxopiperidin-3-yl)benzamide is sourced from PubChem (CID 63662542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).