ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate

C15H28N4O4 — CID 19021279

IUPACethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate
SMILESCCOC(=O)CN1C(C)(C)CC(NC(=O)C(=O)NN)CC1(C)C
InChIInChI=1S/C15H28N4O4/c1-6-23-11(20)9-19-14(2,3)7-10(8-15(19,4)5)17-12(21)13(22)18-16/h10H,6-9,16H2,1-5H3,(H,17,21)(H,18,22)
InChIKeyAZZHNVRGBYCTTN-UHFFFAOYSA-N
MW328.41 g/mol
LogP-0.32
Rot. Bonds4

About ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate

ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate (PubChem CID 19021279) has the molecular formula C15H28N4O4 and a molecular weight of 328.41 g/mol. Its IUPAC name is ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate.

Molecular Properties

Compound Nameethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate
PubChem CID19021279
Molecular FormulaC15H28N4O4
Molecular Weight328.41 g/mol
Exact Mass328.21
IUPAC Nameethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate
SMILESCCOC(=O)CN1C(C)(C)CC(NC(=O)C(=O)NN)CC1(C)C
InChIInChI=1S/C15H28N4O4/c1-6-23-11(20)9-19-14(2,3)7-10(8-15(19,4)5)17-12(21)13(22)18-16/h10H,6-9,16H2,1-5H3,(H,17,21)(H,18,22)
InChIKeyAZZHNVRGBYCTTN-UHFFFAOYSA-N
XLogP-0.32
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate?
The IUPAC name of ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate (CID 19021279) is ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate.
What is the SMILES notation for ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate?
The canonical SMILES for ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate is CCOC(=O)CN1C(C)(C)CC(NC(=O)C(=O)NN)CC1(C)C.
What is the InChIKey of ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate?
The InChIKey is AZZHNVRGBYCTTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O4/c1-6-23-11(20)9-19-14(2,3)7-10(8-15(19,4)5)17-12(21)13(22)18-16/h10H,6-9,16H2,1-5H3,(H,17,21)(H,18,22).
What are the key properties of ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate?
ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate has a molecular weight of 328.41 g/mol, XLogP of -0.32, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[4-[(2-hydrazinyl-2-oxoacetyl)amino]-2,2,6,6-tetramethylpiperidin-1-yl]acetate is sourced from PubChem (CID 19021279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).