N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide

C15H24N4O2 — CID 59540175

IUPACN-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCCC1c1ncc(C(C)(C)C)[nH]1
InChIInChI=1S/C15H24N4O2/c1-10(20)16-9-13(21)19-7-5-6-11(19)14-17-8-12(18-14)15(2,3)4/h8,11H,5-7,9H2,1-4H3,(H,16,20)(H,17,18)
InChIKeyRDSKWOLASAFKII-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.51
Rot. Bonds3

About N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide

N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide (PubChem CID 59540175) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide.

Molecular Properties

Compound NameN-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide
PubChem CID59540175
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide
SMILESCC(=O)NCC(=O)N1CCCC1c1ncc(C(C)(C)C)[nH]1
InChIInChI=1S/C15H24N4O2/c1-10(20)16-9-13(21)19-7-5-6-11(19)14-17-8-12(18-14)15(2,3)4/h8,11H,5-7,9H2,1-4H3,(H,16,20)(H,17,18)
InChIKeyRDSKWOLASAFKII-UHFFFAOYSA-N
XLogP1.51
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-acetamidoacetyl)-N-propan-2-ylpyrrolidine-2-carboxamide;N-[2-[2-(2-tert-butyl-1H-imidazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide;N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide
CID 158449922
(2S)-2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidine-1-carboxylic acid
CID 175507470
N-[[6-[1-(2-acetamidoacetyl)pyrrolidin-2-yl]pyrazin-2-yl]methyl]acetamide
CID 110094831
1-methyl-3-[2-oxo-2-[2-(5-phenyl-1H-imidazol-2-yl)piperidin-1-yl]ethyl]urea
CID 119037018
4-[2-(5-methyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-4-oxobutanoic acid
CID 73439663
[2-[2-[5-[4-[4-[2-(1-butanoylpyrrolidin-2-yl)-1H-imidazol-5-yl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]carbamic acid
CID 145196171
methyl N-[2-[(2R)-2-(1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]carbamate
CID 144971063
methyl N-[2-[(2S)-2-[5-[4-[4-[2-(1,5-dimethylpyrrolidin-2-yl)-1H-imidazol-5-yl]phenyl]phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]carbamate
CID 145150457
methyl N-[2-[(2S)-2-[5-[2-(4-bromophenyl)ethynyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]carbamate
CID 134422252
methyl N-[2-[(2S)-2-[5-[3-(2-fluorophenyl)-4-methylphenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]carbamate
CID 145269727
N-[2-[2-[5-[(2-chlorophenyl)methyl]-1,3-oxazol-2-yl]pyrrolidin-1-yl]-2-oxoethyl]acetamide
CID 110120557
methyl N-[2-oxo-2-[2-[5-[4-(3-phenylthieno[3,2-b]thiophen-6-yl)phenyl]-1H-imidazol-2-yl]pyrrolidin-1-yl]ethyl]carbamate
CID 70812965

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide?
The IUPAC name of N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide (CID 59540175) is N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide.
What is the SMILES notation for N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide?
The canonical SMILES for N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide is CC(=O)NCC(=O)N1CCCC1c1ncc(C(C)(C)C)[nH]1.
What is the InChIKey of N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide?
The InChIKey is RDSKWOLASAFKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-10(20)16-9-13(21)19-7-5-6-11(19)14-17-8-12(18-14)15(2,3)4/h8,11H,5-7,9H2,1-4H3,(H,16,20)(H,17,18).
What are the key properties of N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide?
N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(5-tert-butyl-1H-imidazol-2-yl)pyrrolidin-1-yl]-2-oxoethyl]acetamide is sourced from PubChem (CID 59540175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).