2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide

C13H27N3O — CID 78986739

IUPAC2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide
SMILESCCN1CCC(NC(=O)CNC(C)(C)C)CC1
InChIInChI=1S/C13H27N3O/c1-5-16-8-6-11(7-9-16)15-12(17)10-14-13(2,3)4/h11,14H,5-10H2,1-4H3,(H,15,17)
InChIKeyMZJCGQQDVUOBHB-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.98
Rot. Bonds4

About 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide

2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide (PubChem CID 78986739) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide
PubChem CID78986739
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide
SMILESCCN1CCC(NC(=O)CNC(C)(C)C)CC1
InChIInChI=1S/C13H27N3O/c1-5-16-8-6-11(7-9-16)15-12(17)10-14-13(2,3)4/h11,14H,5-10H2,1-4H3,(H,15,17)
InChIKeyMZJCGQQDVUOBHB-UHFFFAOYSA-N
XLogP0.98
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(tert-butylamino)acetamide
CID 49487861
2-(tert-butylamino)-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]acetamide
CID 49488670
2-(cyclopropylmethylamino)-N-(1-ethylpiperidin-4-yl)acetamide
CID 54917428
2-(tert-butylamino)-N-(4-propylcyclohexyl)acetamide
CID 78986680
2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-(1-ethylpiperidin-4-yl)acetamide
CID 86908543
2-amino-N-(1-ethylpiperidin-4-yl)-2-methylpropanamide
CID 61266826
N-cyclopropyl-2-[1-(1-ethylpiperidin-4-yl)ethylamino]acetamide
CID 43568260
N-(1-ethylpiperidin-4-yl)-4-hydroxybutanamide
CID 79192481
(1-ethylpiperidin-4-yl)carbamic acid;hydrochloride
CID 68989076
2-(tert-butylamino)-N-(1-methylpiperidin-3-yl)acetamide
CID 78986831
N-(1-ethylpiperidin-4-yl)-2-[4-[(2S)-2-hydroxypropyl]piperazin-1-yl]acetamide
CID 95335405
N-tert-butyl-2-[(1-ethylazepan-4-yl)amino]acetamide
CID 113293184

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide (CID 78986739) is 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide is CCN1CCC(NC(=O)CNC(C)(C)C)CC1.
What is the InChIKey of 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide?
The InChIKey is MZJCGQQDVUOBHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-5-16-8-6-11(7-9-16)15-12(17)10-14-13(2,3)4/h11,14H,5-10H2,1-4H3,(H,15,17).
What are the key properties of 2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide?
2-(tert-butylamino)-N-(1-ethylpiperidin-4-yl)acetamide has a molecular weight of 241.38 g/mol, XLogP of 0.98, 4 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-ethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 78986739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).