N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide

C17H24N2O2 — CID 82342704

IUPACN-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide
SMILESCC(C)(C)c1ccc(NC(=O)CN2CCC(=O)CC2)cc1
InChIInChI=1S/C17H24N2O2/c1-17(2,3)13-4-6-14(7-5-13)18-16(21)12-19-10-8-15(20)9-11-19/h4-7H,8-12H2,1-3H3,(H,18,21)
InChIKeyLOVIWJJZMDBJLR-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.59
Rot. Bonds3

About N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide

N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide (PubChem CID 82342704) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide
PubChem CID82342704
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide
SMILESCC(C)(C)c1ccc(NC(=O)CN2CCC(=O)CC2)cc1
InChIInChI=1S/C17H24N2O2/c1-17(2,3)13-4-6-14(7-5-13)18-16(21)12-19-10-8-15(20)9-11-19/h4-7H,8-12H2,1-3H3,(H,18,21)
InChIKeyLOVIWJJZMDBJLR-UHFFFAOYSA-N
XLogP2.59
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-tert-butylanilino)-2-oxoethyl]piperidine-4-carboxylic acid;hydrochloride
CID 119906651
methyl 1-[2-(4-tert-butylanilino)-2-oxoethyl]piperidine-4-carboxylate
CID 8742171
N-(4-tert-butylphenyl)-2-[4-(diethylsulfamoyl)piperazin-1-yl]acetamide
CID 16597788
N-(4-tert-butylphenyl)-2-(1,3-dioxoisoindol-2-yl)acetamide
CID 7658806
2,2-dimethyl-N-[4-[(2-pyrrolidin-1-ylacetyl)amino]phenyl]propanamide
CID 858395
2-(4-benzylsulfonylpiperazin-1-yl)-N-(4-tert-butylphenyl)acetamide
CID 9443469
4-(4-tert-butylphenoxy)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]butanamide
CID 16612050
N-(2-methylphenyl)-2-(4-oxopiperidin-1-yl)acetamide
CID 24693967
N-(4-tert-butylphenyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 17466104
2-(5-amino-2-oxo-1-pyridinyl)-N-(4-tert-butylphenyl)acetamide
CID 82031681
N-(4-aminophenyl)-2-(4-tert-butylpiperazin-1-yl)acetamide
CID 61430101
N-(4-tert-butylphenyl)-2-(2-methylpiperidin-1-yl)acetamide
CID 18078471

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide?
The IUPAC name of N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide (CID 82342704) is N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide?
The canonical SMILES for N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide is CC(C)(C)c1ccc(NC(=O)CN2CCC(=O)CC2)cc1.
What is the InChIKey of N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide?
The InChIKey is LOVIWJJZMDBJLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-17(2,3)13-4-6-14(7-5-13)18-16(21)12-19-10-8-15(20)9-11-19/h4-7H,8-12H2,1-3H3,(H,18,21).
What are the key properties of N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide?
N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide has a molecular weight of 288.39 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylphenyl)-2-(4-oxopiperidin-1-yl)acetamide is sourced from PubChem (CID 82342704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).