(E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide

C19H19N3O3 — CID 71811463

IUPAC(E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide
SMILESO=C(/C=C/c1ccc(N2CCN(Cc3ccccc3)C2=O)cc1)NO
InChIInChI=1S/C19H19N3O3/c23-18(20-25)11-8-15-6-9-17(10-7-15)22-13-12-21(19(22)24)14-16-4-2-1-3-5-16/h1-11,25H,12-14H2,(H,20,23)/b11-8+
InChIKeyJNZAJKLYFHEGLY-DHZHZOJOSA-N
MW337.38 g/mol
LogP2.65
Rot. Bonds5

About (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide

(E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide (PubChem CID 71811463) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide.

Molecular Properties

Compound Name(E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide
PubChem CID71811463
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name(E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide
SMILESO=C(/C=C/c1ccc(N2CCN(Cc3ccccc3)C2=O)cc1)NO
InChIInChI=1S/C19H19N3O3/c23-18(20-25)11-8-15-6-9-17(10-7-15)22-13-12-21(19(22)24)14-16-4-2-1-3-5-16/h1-11,25H,12-14H2,(H,20,23)/b11-8+
InChIKeyJNZAJKLYFHEGLY-DHZHZOJOSA-N
XLogP2.65
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-benzyl-3-(4-bromophenyl)imidazolidin-2-one
CID 118239025
(E)-3-[4-[(E)-3-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-3-oxoprop-1-enyl]phenyl]-N-hydroxyprop-2-enamide
CID 24756555
3-[4-[3-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-3-oxoprop-1-enyl]phenyl]-N-hydroxyprop-2-enamide
CID 91415753
(E)-N-hydroxy-3-[2-[2-oxo-3-[[3-(trifluoromethoxy)phenyl]methyl]imidazolidin-1-yl]phenyl]prop-2-enamide
CID 139382320
4-(3-benzyl-2-oxo-1,3-diazinan-1-yl)-N-phenylbenzamide
CID 50754409
(E)-3-[4-(2-oxopyrrolidin-1-yl)phenyl]-N-phenylmethoxyprop-2-enamide
CID 25490304
(E)-N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-[4-(2-oxopyrrolidin-1-yl)phenyl]prop-2-enamide
CID 46698969
N-hydroxy-3-[4-[3-oxo-3-(4-phenylpiperazin-1-yl)prop-1-enyl]phenyl]prop-2-enamide
CID 75068138
(E)-3-[6-[(1-benzylpiperidin-4-yl)amino]-3-pyridinyl]-N-hydroxyprop-2-enamide
CID 86603772
(E)-3-[3-[(E)-3-[4-(4-benzylpiperazin-1-yl)phenyl]-3-oxoprop-1-enyl]phenyl]-N-hydroxyprop-2-enamide
CID 25207656
(E)-N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-phenylprop-2-enamide
CID 1128763
(E)-3-(2-benzylindazol-5-yl)-N-hydroxyprop-2-enamide
CID 170647942

Frequently Asked Questions

What is the IUPAC name of (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide?
The IUPAC name of (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide (CID 71811463) is (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide.
What is the SMILES notation for (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide?
The canonical SMILES for (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide is O=C(/C=C/c1ccc(N2CCN(Cc3ccccc3)C2=O)cc1)NO.
What is the InChIKey of (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide?
The InChIKey is JNZAJKLYFHEGLY-DHZHZOJOSA-N. The full InChI is InChI=1S/C19H19N3O3/c23-18(20-25)11-8-15-6-9-17(10-7-15)22-13-12-21(19(22)24)14-16-4-2-1-3-5-16/h1-11,25H,12-14H2,(H,20,23)/b11-8+.
What are the key properties of (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide?
(E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide has a molecular weight of 337.38 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-[4-(3-benzyl-2-oxoimidazolidin-1-yl)phenyl]-N-hydroxyprop-2-enamide is sourced from PubChem (CID 71811463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).