N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide

C14H16N4O2 — CID 80579705

IUPACN-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide
SMILESNc1ccccc1NC(=O)Cn1ccn(C2CC2)c1=O
InChIInChI=1S/C14H16N4O2/c15-11-3-1-2-4-12(11)16-13(19)9-17-7-8-18(14(17)20)10-5-6-10/h1-4,7-8,10H,5-6,9,15H2,(H,16,19)
InChIKeyJEEFTIHOLXCFDG-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.21
Rot. Bonds4

About N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide

N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide (PubChem CID 80579705) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide
PubChem CID80579705
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC NameN-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide
SMILESNc1ccccc1NC(=O)Cn1ccn(C2CC2)c1=O
InChIInChI=1S/C14H16N4O2/c15-11-3-1-2-4-12(11)16-13(19)9-17-7-8-18(14(17)20)10-5-6-10/h1-4,7-8,10H,5-6,9,15H2,(H,16,19)
InChIKeyJEEFTIHOLXCFDG-UHFFFAOYSA-N
XLogP1.21
TPSA82.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminophenyl)-3-(3-cyclopropyl-2-oxoimidazol-1-yl)propanamide
CID 80579397
N-(2-amino-4-fluorophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide
CID 80579564
N-(3-bromophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide
CID 116625442
N-(2-aminophenyl)-2-(3-bromo-2-oxo-1-pyridinyl)acetamide
CID 114760013
1-cyclopropyl-3-(2-cyclopropyl-2-oxoethyl)imidazol-2-one
CID 80581537
1-cyclopropyl-3-(2-oxo-3-phenylpropyl)imidazol-2-one
CID 80581344
N-(2-aminophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962477
1-[2-(2-bromophenyl)-2-oxoethyl]-3-cyclopropylimidazol-2-one
CID 80581514
2-[2-[(3-cyclopropyl-2-oxoimidazol-1-yl)methyl]phenyl]acetohydrazide
CID 115465654
N-(2-aminophenyl)-2-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)acetamide
CID 18069905
N-(2-aminophenyl)-2-cyclopentylsulfanylacetamide
CID 63114529
1-cyclopropyl-3-[2-(2-methylphenyl)-2-oxoethyl]imidazol-2-one
CID 80581341

Frequently Asked Questions

What is the IUPAC name of N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide?
The IUPAC name of N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide (CID 80579705) is N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide.
What is the SMILES notation for N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide?
The canonical SMILES for N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide is Nc1ccccc1NC(=O)Cn1ccn(C2CC2)c1=O.
What is the InChIKey of N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide?
The InChIKey is JEEFTIHOLXCFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c15-11-3-1-2-4-12(11)16-13(19)9-17-7-8-18(14(17)20)10-5-6-10/h1-4,7-8,10H,5-6,9,15H2,(H,16,19).
What are the key properties of N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide?
N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide has a molecular weight of 272.31 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminophenyl)-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide is sourced from PubChem (CID 80579705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).