1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one

C15H23N3O — CID 116981276

IUPAC1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one
SMILESCCc1ccc(C2CN(C(C)CN)C(=O)N2C)cc1
InChIInChI=1S/C15H23N3O/c1-4-12-5-7-13(8-6-12)14-10-18(11(2)9-16)15(19)17(14)3/h5-8,11,14H,4,9-10,16H2,1-3H3
InChIKeyHXRKEGDRCLAHMN-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.00
Rot. Bonds4

About 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one

1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one (PubChem CID 116981276) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one
PubChem CID116981276
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one
SMILESCCc1ccc(C2CN(C(C)CN)C(=O)N2C)cc1
InChIInChI=1S/C15H23N3O/c1-4-12-5-7-13(8-6-12)14-10-18(11(2)9-16)15(19)17(14)3/h5-8,11,14H,4,9-10,16H2,1-3H3
InChIKeyHXRKEGDRCLAHMN-UHFFFAOYSA-N
XLogP2.00
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-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

Frequently Asked Questions

What is the IUPAC name of 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one?
The IUPAC name of 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one (CID 116981276) is 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one.
What is the SMILES notation for 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one?
The canonical SMILES for 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one is CCc1ccc(C2CN(C(C)CN)C(=O)N2C)cc1.
What is the InChIKey of 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one?
The InChIKey is HXRKEGDRCLAHMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-4-12-5-7-13(8-6-12)14-10-18(11(2)9-16)15(19)17(14)3/h5-8,11,14H,4,9-10,16H2,1-3H3.
What are the key properties of 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one?
1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one has a molecular weight of 261.37 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminopropan-2-yl)-4-(4-ethylphenyl)-3-methylimidazolidin-2-one is sourced from PubChem (CID 116981276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).