N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide

C24H23N3O3S — CID 55895783

About N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide

N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide (PubChem CID 55895783) has the molecular formula C24H23N3O3S and a molecular weight of 433.53 g/mol. Its IUPAC name is N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide.

Molecular Properties

• Compound Name: N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide
• PubChem CID: 55895783
• Molecular Formula: C24H23N3O3S
• Molecular Weight: 433.53 g/mol
• Exact Mass: 433.15
• IUPAC Name: N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide
• SMILES: Cc1cccnc1NC(=O)C1CCCN(C(=O)c2cc3c(s2)-c2ccccc2OC3)C1
• InChI: InChI=1S/C24H23N3O3S/c1-15-6-4-10-25-22(15)26-23(28)16-7-5-11-27(13-16)24(29)20-12-17-14-30-19-9-3-2-8-18(19)21(17)31-20/h2-4,6,8-10,12,16H,5,7,11,13-14H2,1H3,(H,25,26,28)
• InChIKey: VFYHRAJWRARTHF-UHFFFAOYSA-N
• XLogP: 4.50
• TPSA: 71.53 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	433.53
LogP ≤ 5	4.50
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide?

The IUPAC name of N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide (CID 55895783) is N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide.

What is the SMILES notation for N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide?

The canonical SMILES for N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide is Cc1cccnc1NC(=O)C1CCCN(C(=O)c2cc3c(s2)-c2ccccc2OC3)C1.

What is the InChIKey of N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide?

The InChIKey is VFYHRAJWRARTHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O3S/c1-15-6-4-10-25-22(15)26-23(28)16-7-5-11-27(13-16)24(29)20-12-17-14-30-19-9-3-2-8-18(19)21(17)31-20/h2-4,6,8-10,12,16H,5,7,11,13-14H2,1H3,(H,25,26,28).

What are the key properties of N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide?

N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide has a molecular weight of 433.53 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-(3-methyl-2-pyridinyl)-1-(4H-thieno[3,2-c]chromene-2-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 55895783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).