N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide

C14H16N4O2 — CID 79961931

IUPACN-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C2C(N)=NC(=O)N2C2CC2)cc1
InChIInChI=1S/C14H16N4O2/c1-8(19)16-10-4-2-9(3-5-10)12-13(15)17-14(20)18(12)11-6-7-11/h2-5,11-12H,6-7H2,1H3,(H,16,19)(H2,15,17,20)
InChIKeyNNBDUOSLLSEOQB-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.64
Rot. Bonds3

About N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide

N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide (PubChem CID 79961931) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide
PubChem CID79961931
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC NameN-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C2C(N)=NC(=O)N2C2CC2)cc1
InChIInChI=1S/C14H16N4O2/c1-8(19)16-10-4-2-9(3-5-10)12-13(15)17-14(20)18(12)11-6-7-11/h2-5,11-12H,6-7H2,1H3,(H,16,19)(H2,15,17,20)
InChIKeyNNBDUOSLLSEOQB-UHFFFAOYSA-N
XLogP1.64
TPSA87.79 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(2R)-3-cyclopropyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]acetamide
CID 9008576
N-[4-[(2S)-3-cyclopentyl-4-oxo-1,2-dihydroquinazolin-2-yl]phenyl]acetamide
CID 40795210
2,4-bis(4-acetamidophenyl)cyclobutane-1,3-dicarboxylic acid
CID 90464818
N-(4-acetamidophenyl)-4-cyclopropylpiperazine-1-carboxamide
CID 113103473
N-[4-[(2S)-piperidin-2-yl]phenyl]acetamide;hydrochloride
CID 154574804
N-(4-acetamidophenyl)-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 110687377
N-[4-[(1S,2S)-2-methylcyclohexyl]phenyl]acetamide
CID 826163
N-(4-acetamidophenyl)-2-(3,5-dioxopyrazolidin-4-yl)acetamide
CID 110703357
N-[4-[(1-cyclopropyl-2-oxopyrimidin-4-yl)sulfamoyl]phenyl]acetamide
CID 86734626
N-[4-[3-(cyclopropylmethyl)-5-imino-2-oxoimidazolidin-4-yl]phenyl]acetamide
CID 138390834
N-[4-[[[(3R)-1-cycloheptyl-5-oxopyrrolidin-3-yl]amino]methyl]phenyl]acetamide
CID 42193726
N-[4-(5-acetyl-2-amino-4-oxo-3,6,7,8-tetrahydropteridin-6-yl)phenyl]acetamide
CID 136711734

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide?
The IUPAC name of N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide (CID 79961931) is N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide.
What is the SMILES notation for N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide?
The canonical SMILES for N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide is CC(=O)Nc1ccc(C2C(N)=NC(=O)N2C2CC2)cc1.
What is the InChIKey of N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide?
The InChIKey is NNBDUOSLLSEOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-8(19)16-10-4-2-9(3-5-10)12-13(15)17-14(20)18(12)11-6-7-11/h2-5,11-12H,6-7H2,1H3,(H,16,19)(H2,15,17,20).
What are the key properties of N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide?
N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide has a molecular weight of 272.31 g/mol, XLogP of 1.64, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-amino-3-cyclopropyl-2-oxo-4H-imidazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 79961931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).