N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride

C19H25ClN4O2 — CID 120931190

About N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride

N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride (PubChem CID 120931190) has the molecular formula C19H25ClN4O2 and a molecular weight of 376.89 g/mol. Its IUPAC name is N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride.

Molecular Properties

• Compound Name: N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
• PubChem CID: 120931190
• Molecular Formula: C19H25ClN4O2
• Molecular Weight: 376.89 g/mol
• Exact Mass: 376.17
• IUPAC Name: N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride
• SMILES: Cc1ccc2c(c1C)OCC2NC(=O)C1(n2cccn2)CCNCC1.Cl
• InChI: InChI=1S/C19H24N4O2.ClH/c1-13-4-5-15-16(12-25-17(15)14(13)2)22-18(24)19(6-9-20-10-7-19)23-11-3-8-21-23;/h3-5,8,11,16,20H,6-7,9-10,12H2,1-2H3,(H,22,24);1H
• InChIKey: KYRZCEGLCPQBFG-UHFFFAOYSA-N
• XLogP: 2.25
• TPSA: 68.18 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	376.89
LogP ≤ 5	2.25
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride?

The IUPAC name of N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride (CID 120931190) is N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride.

What is the SMILES notation for N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride?

The canonical SMILES for N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride is Cc1ccc2c(c1C)OCC2NC(=O)C1(n2cccn2)CCNCC1.Cl.

What is the InChIKey of N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride?

The InChIKey is KYRZCEGLCPQBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2.ClH/c1-13-4-5-15-16(12-25-17(15)14(13)2)22-18(24)19(6-9-20-10-7-19)23-11-3-8-21-23;/h3-5,8,11,16,20H,6-7,9-10,12H2,1-2H3,(H,22,24);1H.

What are the key properties of N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride?

N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride has a molecular weight of 376.89 g/mol, XLogP of 2.25, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(6,7-dimethyl-2,3-dihydro-1-benzofuran-3-yl)-4-pyrazol-1-ylpiperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 120931190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).