2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide

C16H31N3O2 — CID 49488670

IUPAC2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide
SMILESCC(C)(C)NCC(=O)NC1CCN(C(=O)C(C)(C)C)CC1
InChIInChI=1S/C16H31N3O2/c1-15(2,3)14(21)19-9-7-12(8-10-19)18-13(20)11-17-16(4,5)6/h12,17H,7-11H2,1-6H3,(H,18,20)
InChIKeyGHDYYYRFLMKLCN-UHFFFAOYSA-N
MW297.44 g/mol
LogP1.53
Rot. Bonds3

About 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide

2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide (PubChem CID 49488670) has the molecular formula C16H31N3O2 and a molecular weight of 297.44 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide
PubChem CID49488670
Molecular FormulaC16H31N3O2
Molecular Weight297.44 g/mol
Exact Mass297.24
IUPAC Name2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide
SMILESCC(C)(C)NCC(=O)NC1CCN(C(=O)C(C)(C)C)CC1
InChIInChI=1S/C16H31N3O2/c1-15(2,3)14(21)19-9-7-12(8-10-19)18-13(20)11-17-16(4,5)6/h12,17H,7-11H2,1-6H3,(H,18,20)
InChIKeyGHDYYYRFLMKLCN-UHFFFAOYSA-N
XLogP1.53
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.44
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-3,3-dimethylbutanamide
CID 110819893
2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide
CID 78986739
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-4-hydroxybutanamide
CID 79204128
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(tert-butylamino)acetamide
CID 49487861
N-[1-[2-(tert-butylamino)acetyl]piperidin-4-yl]cyclopropanecarboxamide
CID 112730369
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2-(2-methoxyethoxy)acetamide
CID 108557795
2-amino-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-3,3-dimethylbutanamide
CID 76887363
2-(1-aminocyclobutyl)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide
CID 79843554
3-chloro-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-2,2-dimethylpropanamide
CID 63680198
2-(tert-butylamino)-N-(4-propylcyclohexyl)acetamide
CID 78986680
2-(tert-butylamino)-N-(1-methylpiperidin-3-yl)acetamide
CID 78986831
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]but-2-enamide
CID 112727975

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide (CID 49488670) is 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide is CC(C)(C)NCC(=O)NC1CCN(C(=O)C(C)(C)C)CC1.
What is the InChIKey of 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide?
The InChIKey is GHDYYYRFLMKLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O2/c1-15(2,3)14(21)19-9-7-12(8-10-19)18-13(20)11-17-16(4,5)6/h12,17H,7-11H2,1-6H3,(H,18,20).
What are the key properties of 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide?
2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide has a molecular weight of 297.44 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 49488670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).