1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one

C18H19N3O — CID 14834287

IUPAC1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one
SMILESO=C1N(C/C=C/c2ccccc2)CCN1Cc1ccccn1
InChIInChI=1S/C18H19N3O/c22-18-20(12-6-9-16-7-2-1-3-8-16)13-14-21(18)15-17-10-4-5-11-19-17/h1-11H,12-15H2/b9-6+
InChIKeyQYIUWOSDYTUDMO-RMKNXTFCSA-N
MW293.37 g/mol
LogP3.03
Rot. Bonds5

About 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one

1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one (PubChem CID 14834287) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one
PubChem CID14834287
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one
SMILESO=C1N(C/C=C/c2ccccc2)CCN1Cc1ccccn1
InChIInChI=1S/C18H19N3O/c22-18-20(12-6-9-16-7-2-1-3-8-16)13-14-21(18)15-17-10-4-5-11-19-17/h1-11H,12-15H2/b9-6+
InChIKeyQYIUWOSDYTUDMO-RMKNXTFCSA-N
XLogP3.03
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(E)-3-phenylprop-2-enyl]-N-(pyridin-2-ylmethyl)piperazine-1-carboxamide
CID 108989085
N-[(E)-3-phenylprop-2-enyl]-1-(pyridin-2-ylmethyl)piperidin-4-amine
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1-benzyl-4-(pyridin-2-ylmethyl)piperazin-2-one
CID 154580851
(1S,5R)-3-[3-(4-fluorophenyl)prop-2-enyl]-6-(pyridin-2-ylmethyl)-3,6-diazabicyclo[3.2.2]nonan-7-one
CID 91939944
3-[(Z)-3-phenylprop-2-enyl]pyrido[2,3-e][1,3]oxazine-2,4-dione
CID 99865788
10-(3-phenylprop-2-enyl)-3-pyrimidin-2-yl-7-oxa-3,10-diazaspiro[5.6]dodecan-11-one
CID 171148186
3-methyl-1-(pyridin-2-ylmethyl)piperazin-2-one
CID 63606119
2-(3-pyridin-4-ylprop-2-enyl)pyridine
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1-(pyridin-2-ylmethyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid
CID 60838604
1-[1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]pyrazol-4-yl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one
CID 123271775
1-[(E)-3-phenylprop-2-enyl]azepane
CID 10867670
N-tert-butyl-1,3-bis[(E)-3-phenylprop-2-enyl]imidazolidin-2-imine
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Frequently Asked Questions

What is the IUPAC name of 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one?
The IUPAC name of 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one (CID 14834287) is 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one.
What is the SMILES notation for 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one?
The canonical SMILES for 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one is O=C1N(C/C=C/c2ccccc2)CCN1Cc1ccccn1.
What is the InChIKey of 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one?
The InChIKey is QYIUWOSDYTUDMO-RMKNXTFCSA-N. The full InChI is InChI=1S/C18H19N3O/c22-18-20(12-6-9-16-7-2-1-3-8-16)13-14-21(18)15-17-10-4-5-11-19-17/h1-11H,12-15H2/b9-6+.
What are the key properties of 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one?
1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one has a molecular weight of 293.37 g/mol, XLogP of 3.03, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-3-phenylprop-2-enyl]-3-(pyridin-2-ylmethyl)imidazolidin-2-one is sourced from PubChem (CID 14834287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).