10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride

C19H22ClN3O — CID 19097302

About 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride

10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride (PubChem CID 19097302) has the molecular formula C19H22ClN3O and a molecular weight of 343.86 g/mol. Its IUPAC name is 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride.

Molecular Properties

• Compound Name: 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride
• PubChem CID: 19097302
• Molecular Formula: C19H22ClN3O
• Molecular Weight: 343.86 g/mol
• Exact Mass: 343.15
• IUPAC Name: 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride
• SMILES: CCc1c2n(c3ccccc13)C(=O)C(Cc1nc[nH]c1C)CC2.Cl
• InChI: InChI=1S/C19H21N3O.ClH/c1-3-14-15-6-4-5-7-17(15)22-18(14)9-8-13(19(22)23)10-16-12(2)20-11-21-16;/h4-7,11,13H,3,8-10H2,1-2H3,(H,20,21);1H
• InChIKey: BIHIJXAPDABOJN-UHFFFAOYSA-N
• XLogP: 4.10
• TPSA: 50.68 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	343.86
LogP ≤ 5	4.10
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride?

The IUPAC name of 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride (CID 19097302) is 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride.

What is the SMILES notation for 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride?

The canonical SMILES for 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride is CCc1c2n(c3ccccc13)C(=O)C(Cc1nc[nH]c1C)CC2.Cl.

What is the InChIKey of 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride?

The InChIKey is BIHIJXAPDABOJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O.ClH/c1-3-14-15-6-4-5-7-17(15)22-18(14)9-8-13(19(22)23)10-16-12(2)20-11-21-16;/h4-7,11,13H,3,8-10H2,1-2H3,(H,20,21);1H.

What are the key properties of 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride?

10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride has a molecular weight of 343.86 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 10-ethyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one;hydrochloride is sourced from PubChem (CID 19097302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).