3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide

C12H23N3O2 — CID 65266745

IUPAC3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide
SMILESCC(C)(N)C(C)(C)C(=O)NC1CCCNC1=O
InChIInChI=1S/C12H23N3O2/c1-11(2,12(3,4)13)10(17)15-8-6-5-7-14-9(8)16/h8H,5-7,13H2,1-4H3,(H,14,16)(H,15,17)
InChIKeyBKSWEGHEFYEWIU-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.14
Rot. Bonds3

About 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide

3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide (PubChem CID 65266745) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide.

Molecular Properties

Compound Name3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide
PubChem CID65266745
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide
SMILESCC(C)(N)C(C)(C)C(=O)NC1CCCNC1=O
InChIInChI=1S/C12H23N3O2/c1-11(2,12(3,4)13)10(17)15-8-6-5-7-14-9(8)16/h8H,5-7,13H2,1-4H3,(H,14,16)(H,15,17)
InChIKeyBKSWEGHEFYEWIU-UHFFFAOYSA-N
XLogP0.14
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-methyl-N-(2-oxopiperidin-3-yl)propanamide
CID 62092380
3-amino-2,2-dimethyl-N-(2-oxopiperidin-3-yl)propanamide;hydrochloride
CID 119756732
3-amino-2,2-dimethyl-N-(2-oxoazepan-3-yl)propanamide
CID 81490080
2,2-dimethyl-N-[(3S)-2-oxoazepan-3-yl]butanamide
CID 11322108
1-amino-N-(2-oxopiperidin-3-yl)cyclopropane-1-carboxamide
CID 65466237
2-(tert-butylamino)-N-(2-oxopiperidin-3-yl)acetamide
CID 49495846
3-(tert-butylamino)-N-(2-oxopiperidin-3-yl)propanamide
CID 55033831
(2S)-2-hydroxy-N-(2-oxopiperidin-3-yl)propanamide
CID 130978731
3-amino-2,2,3-trimethyl-N-(2-oxooxolan-3-yl)butanamide
CID 142101132
N-(2-oxopiperidin-3-yl)butanamide
CID 62054699
2,2,3,3,4,4,4-heptafluoro-N-(2-oxoazepan-3-yl)butanamide
CID 122206979
4-methyl-N-(2-oxopiperidin-3-yl)piperidine-4-carboxamide
CID 55176788

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide?
The IUPAC name of 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide (CID 65266745) is 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide.
What is the SMILES notation for 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide?
The canonical SMILES for 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide is CC(C)(N)C(C)(C)C(=O)NC1CCCNC1=O.
What is the InChIKey of 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide?
The InChIKey is BKSWEGHEFYEWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-11(2,12(3,4)13)10(17)15-8-6-5-7-14-9(8)16/h8H,5-7,13H2,1-4H3,(H,14,16)(H,15,17).
What are the key properties of 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide?
3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide has a molecular weight of 241.33 g/mol, XLogP of 0.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2,3-trimethyl-N-(2-oxopiperidin-3-yl)butanamide is sourced from PubChem (CID 65266745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).