1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride

C19H25ClN6O3 — CID 120877283

About 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride

1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride (PubChem CID 120877283) has the molecular formula C19H25ClN6O3 and a molecular weight of 420.90 g/mol. Its IUPAC name is 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride.

Molecular Properties

• Compound Name: 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride
• PubChem CID: 120877283
• Molecular Formula: C19H25ClN6O3
• Molecular Weight: 420.90 g/mol
• Exact Mass: 420.17
• IUPAC Name: 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride
• SMILES: COc1ccc(C(=O)N2CCNCC2c2nccn2C)cc1N1CCNC1=O.Cl
• InChI: InChI=1S/C19H24N6O3.ClH/c1-23-8-6-21-17(23)15-12-20-5-9-24(15)18(26)13-3-4-16(28-2)14(11-13)25-10-7-22-19(25)27;/h3-4,6,8,11,15,20H,5,7,9-10,12H2,1-2H3,(H,22,27);1H
• InChIKey: CWXDLRZTMCSOGS-UHFFFAOYSA-N
• XLogP: 1.17
• TPSA: 91.73 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	420.90
LogP ≤ 5	1.17
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride?

The IUPAC name of 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride (CID 120877283) is 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride.

What is the SMILES notation for 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride?

The canonical SMILES for 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride is COc1ccc(C(=O)N2CCNCC2c2nccn2C)cc1N1CCNC1=O.Cl.

What is the InChIKey of 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride?

The InChIKey is CWXDLRZTMCSOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O3.ClH/c1-23-8-6-21-17(23)15-12-20-5-9-24(15)18(26)13-3-4-16(28-2)14(11-13)25-10-7-22-19(25)27;/h3-4,6,8,11,15,20H,5,7,9-10,12H2,1-2H3,(H,22,27);1H.

What are the key properties of 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride?

1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride has a molecular weight of 420.90 g/mol, XLogP of 1.17, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-methoxy-5-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]phenyl]imidazolidin-2-one;hydrochloride is sourced from PubChem (CID 120877283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).