4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one

C14H21N3O2 — CID 116978630

IUPAC4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one
SMILESCNCCCN1CC(c2cccc(OC)c2)NC1=O
InChIInChI=1S/C14H21N3O2/c1-15-7-4-8-17-10-13(16-14(17)18)11-5-3-6-12(9-11)19-2/h3,5-6,9,13,15H,4,7-8,10H2,1-2H3,(H,16,18)
InChIKeyTWRPEEVVQBUNNB-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.37
Rot. Bonds6

About 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one

4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one (PubChem CID 116978630) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one
PubChem CID116978630
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one
SMILESCNCCCN1CC(c2cccc(OC)c2)NC1=O
InChIInChI=1S/C14H21N3O2/c1-15-7-4-8-17-10-13(16-14(17)18)11-5-3-6-12(9-11)19-2/h3,5-6,9,13,15H,4,7-8,10H2,1-2H3,(H,16,18)
InChIKeyTWRPEEVVQBUNNB-UHFFFAOYSA-N
XLogP1.37
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-aminopropyl)-4-(3-methoxyphenyl)imidazolidin-2-one
CID 116978424
4-(3-methoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one
CID 116980510
4-(3-methoxyphenyl)-1-pyrrolidin-3-ylimidazolidin-2-one
CID 116978989
7-(3-methoxyphenyl)azepan-2-one
CID 12665502
4-(4-ethoxyphenyl)-1-(3-hydroxypropyl)imidazolidin-2-one
CID 116979433
6-(3-methoxyphenyl)piperidine-2,4-dione
CID 83822055
2-[4-(2,4-dimethoxyphenyl)-2-oxoimidazolidin-1-yl]acetonitrile
CID 116980156
2-(3-methoxyphenyl)-1-methyl-2,5-dihydropyrrole
CID 70452828
N-[3-[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]propyl]methanesulfonamide
CID 94797205
5-ethoxy-6-(3-methoxyphenyl)-3,4-dimethyl-1,6-dihydropyrimidin-2-one
CID 19576241
1-[4-(3-methoxyphenyl)piperidin-1-yl]-2-(methylamino)ethanone
CID 110460440
2-(methoxymethyl)-5-(3-methoxyphenyl)pyrrolidine
CID 105477705

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one?
The IUPAC name of 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one (CID 116978630) is 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one.
What is the SMILES notation for 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one?
The canonical SMILES for 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one is CNCCCN1CC(c2cccc(OC)c2)NC1=O.
What is the InChIKey of 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one?
The InChIKey is TWRPEEVVQBUNNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-15-7-4-8-17-10-13(16-14(17)18)11-5-3-6-12(9-11)19-2/h3,5-6,9,13,15H,4,7-8,10H2,1-2H3,(H,16,18).
What are the key properties of 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one?
4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one has a molecular weight of 263.34 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-1-[3-(methylamino)propyl]imidazolidin-2-one is sourced from PubChem (CID 116978630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).