N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide

C17H20N4O2 — CID 56867925

IUPACN-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nccn2CCN2CCCC2=O)cc1
InChIInChI=1S/C17H20N4O2/c1-13(22)19-15-6-4-14(5-7-15)17-18-8-10-21(17)12-11-20-9-2-3-16(20)23/h4-8,10H,2-3,9,11-12H2,1H3,(H,19,22)
InChIKeyPNSNBXQVWMESOU-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.13
Rot. Bonds5

About N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide

N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide (PubChem CID 56867925) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide
PubChem CID56867925
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC NameN-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2nccn2CCN2CCCC2=O)cc1
InChIInChI=1S/C17H20N4O2/c1-13(22)19-15-6-4-14(5-7-15)17-18-8-10-21(17)12-11-20-9-2-3-16(20)23/h4-8,10H,2-3,9,11-12H2,1H3,(H,19,22)
InChIKeyPNSNBXQVWMESOU-UHFFFAOYSA-N
XLogP2.13
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[1-(2-aminoethyl)imidazol-2-yl]phenyl]acetamide
CID 82559349
1-[3-[2-(3-hydroxyphenyl)imidazol-1-yl]propyl]pyrrolidin-2-one
CID 67608745
N-[4-[1-(1,3-thiazol-2-ylmethyl)imidazol-2-yl]phenyl]acetamide
CID 70732819
N-[4-[1-[(4-sulfamoylphenyl)methyl]imidazol-2-yl]phenyl]acetamide
CID 56869896
N-[4-[[9-[2-(2-oxopyrrolidin-1-yl)ethyl]-2-(pyrimidin-4-ylamino)purin-6-yl]amino]phenyl]acetamide
CID 117079969
N-(4-fluorophenyl)-2-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]acetamide
CID 90560761
1-[4-[2-(2-phenylimidazol-1-yl)ethyl]piperazin-1-yl]ethanone
CID 90560576
N-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 7686436
N-[3-[1-[2-(dimethylamino)ethyl]imidazol-2-yl]phenyl]acetamide
CID 82559432
1-[[3-[(2-methylimidazol-1-yl)methyl]phenyl]methyl]-3-[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]urea
CID 78890661
2-N-(4-methylphenyl)-3-N-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrazine-2,3-dicarboxamide
CID 11509899
N-(4-acetamidophenyl)-2-[4-[(2-methylimidazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 90494672

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide?
The IUPAC name of N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide (CID 56867925) is N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide?
The canonical SMILES for N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide is CC(=O)Nc1ccc(-c2nccn2CCN2CCCC2=O)cc1.
What is the InChIKey of N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide?
The InChIKey is PNSNBXQVWMESOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-13(22)19-15-6-4-14(5-7-15)17-18-8-10-21(17)12-11-20-9-2-3-16(20)23/h4-8,10H,2-3,9,11-12H2,1H3,(H,19,22).
What are the key properties of N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide?
N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide has a molecular weight of 312.37 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-[2-(2-oxopyrrolidin-1-yl)ethyl]imidazol-2-yl]phenyl]acetamide is sourced from PubChem (CID 56867925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).