N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide

C11H21N3O2 — CID 63661937

IUPACN-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide
SMILESCC(C)(C)NC(=O)CNC1CCC(=O)NC1
InChIInChI=1S/C11H21N3O2/c1-11(2,3)14-10(16)7-12-8-4-5-9(15)13-6-8/h8,12H,4-7H2,1-3H3,(H,13,15)(H,14,16)
InChIKeyYAPVRPSBPSPUIC-UHFFFAOYSA-N
MW227.31 g/mol
LogP-0.23
Rot. Bonds3

About N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide

N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide (PubChem CID 63661937) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide
PubChem CID63661937
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC NameN-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide
SMILESCC(C)(C)NC(=O)CNC1CCC(=O)NC1
InChIInChI=1S/C11H21N3O2/c1-11(2,3)14-10(16)7-12-8-4-5-9(15)13-6-8/h8,12H,4-7H2,1-3H3,(H,13,15)(H,14,16)
InChIKeyYAPVRPSBPSPUIC-UHFFFAOYSA-N
XLogP-0.23
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide?
The IUPAC name of N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide (CID 63661937) is N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide is CC(C)(C)NC(=O)CNC1CCC(=O)NC1.
What is the InChIKey of N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide?
The InChIKey is YAPVRPSBPSPUIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-11(2,3)14-10(16)7-12-8-4-5-9(15)13-6-8/h8,12H,4-7H2,1-3H3,(H,13,15)(H,14,16).
What are the key properties of N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide?
N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide has a molecular weight of 227.31 g/mol, XLogP of -0.23, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(6-oxopiperidin-3-yl)amino]acetamide is sourced from PubChem (CID 63661937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).