1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one

C16H23N3O2 — CID 80579661

IUPAC1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one
SMILESCCCn1ccn(CC(NC)c2ccccc2OC)c1=O
InChIInChI=1S/C16H23N3O2/c1-4-9-18-10-11-19(16(18)20)12-14(17-2)13-7-5-6-8-15(13)21-3/h5-8,10-11,14,17H,4,9,12H2,1-3H3
InChIKeyYNZHUXVTECEDKN-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.03
Rot. Bonds7

About 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one

1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one (PubChem CID 80579661) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one.

Molecular Properties

Compound Name1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one
PubChem CID80579661
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one
SMILESCCCn1ccn(CC(NC)c2ccccc2OC)c1=O
InChIInChI=1S/C16H23N3O2/c1-4-9-18-10-11-19(16(18)20)12-14(17-2)13-7-5-6-8-15(13)21-3/h5-8,10-11,14,17H,4,9,12H2,1-3H3
InChIKeyYNZHUXVTECEDKN-UHFFFAOYSA-N
XLogP2.03
TPSA48.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-4-methylpyrazine-2,3-dione
CID 62927691
1-[2-(2-methoxyphenyl)-2-(propylamino)ethyl]-3-methylimidazol-2-one
CID 80579539
1-ethyl-3-[2-(2-methoxy-5-methylphenyl)-2-(methylamino)ethyl]imidazol-2-one
CID 80579333
1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-4-methylpyridin-2-one
CID 62962498
1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-methylimidazolidin-2-one
CID 62491847
1-[2-(2-methoxyphenoxy)ethyl]-3-propylimidazol-2-one
CID 116624789
1-[2-(methylamino)-2-(3-methylphenyl)ethyl]-3-propylimidazol-2-one
CID 80581733
1-[2-(methylamino)butyl]-3-propylimidazol-2-one
CID 80581786
1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-4-propylpyrrolidin-2-one
CID 104511373
1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-4-propan-2-ylpyrrolidin-2-one
CID 104511467
1-(2-methoxyphenyl)-N-methylhexan-1-amine
CID 62608289
1-(2-methoxyphenyl)-N-methyl-2-(2-propoxyethoxy)ethanamine
CID 63686193

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one?
The IUPAC name of 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one (CID 80579661) is 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one.
What is the SMILES notation for 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one?
The canonical SMILES for 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one is CCCn1ccn(CC(NC)c2ccccc2OC)c1=O.
What is the InChIKey of 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one?
The InChIKey is YNZHUXVTECEDKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-4-9-18-10-11-19(16(18)20)12-14(17-2)13-7-5-6-8-15(13)21-3/h5-8,10-11,14,17H,4,9,12H2,1-3H3.
What are the key properties of 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one?
1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one has a molecular weight of 289.38 g/mol, XLogP of 2.03, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyphenyl)-2-(methylamino)ethyl]-3-propylimidazol-2-one is sourced from PubChem (CID 80579661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).