1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one

C11H15N3O2 — CID 61014700

IUPAC1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one
SMILESCOc1ccc(N)cc1CN1CCNC1=O
InChIInChI=1S/C11H15N3O2/c1-16-10-3-2-9(12)6-8(10)7-14-5-4-13-11(14)15/h2-3,6H,4-5,7,12H2,1H3,(H,13,15)
InChIKeyAZXCTCSBXANSBE-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.80
Rot. Bonds3

About 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one

1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one (PubChem CID 61014700) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one
PubChem CID61014700
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one
SMILESCOc1ccc(N)cc1CN1CCNC1=O
InChIInChI=1S/C11H15N3O2/c1-16-10-3-2-9(12)6-8(10)7-14-5-4-13-11(14)15/h2-3,6H,4-5,7,12H2,1H3,(H,13,15)
InChIKeyAZXCTCSBXANSBE-UHFFFAOYSA-N
XLogP0.80
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-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

4-[(5-amino-2-methoxyphenyl)methyl]-1,4-diazepan-2-one
CID 65361272
1-[2-(4-amino-2-methoxyphenyl)sulfanylethyl]imidazolidin-2-one
CID 79830082
1-[2-(4-amino-2-methoxyphenyl)sulfonylethyl]imidazolidin-2-one
CID 81206716
1-[(5-amino-2-methoxyphenyl)methyl]azepane-2,7-dione
CID 43447450
3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-4-methoxyaniline
CID 43581167
4-[(5-amino-2-methoxyphenyl)methyl]morpholine-3,5-dione
CID 61328540
5-[(Z)-2-aminoprop-1-enyl]-4-[(5-fluoro-2-methoxyphenyl)methyl]-2,3-dihydro-1H-pyrazin-6-amine
CID 138508236
2-[(5-amino-2-methoxyphenyl)methyl]-5-methyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
CID 114391454
1-[(5-amino-2-methoxyphenyl)methyl]-5-chloropyrimidine-2,4-dione
CID 66423554
[(2R)-1-[(5-amino-2-methoxyphenyl)methyl]pyrrolidin-2-yl]methanol
CID 70140500
4-[(2-methoxy-5-methylphenyl)methyl]-2,3-dihydro-1H-quinoxaline
CID 62160462
1-[(5-ethyl-2-methoxyphenyl)methyl]piperazin-2-one
CID 82296410

Frequently Asked Questions

What is the IUPAC name of 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one?
The IUPAC name of 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one (CID 61014700) is 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one.
What is the SMILES notation for 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one?
The canonical SMILES for 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one is COc1ccc(N)cc1CN1CCNC1=O.
What is the InChIKey of 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one?
The InChIKey is AZXCTCSBXANSBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-16-10-3-2-9(12)6-8(10)7-14-5-4-13-11(14)15/h2-3,6H,4-5,7,12H2,1H3,(H,13,15).
What are the key properties of 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one?
1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one has a molecular weight of 221.26 g/mol, XLogP of 0.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-amino-2-methoxyphenyl)methyl]imidazolidin-2-one is sourced from PubChem (CID 61014700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).