N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide

C19H22N2O2S — CID 97389978

About N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide

N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide (PubChem CID 97389978) has the molecular formula C19H22N2O2S and a molecular weight of 342.46 g/mol. Its IUPAC name is N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide.

Molecular Properties

• Compound Name: N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide
• PubChem CID: 97389978
• Molecular Formula: C19H22N2O2S
• Molecular Weight: 342.46 g/mol
• Exact Mass: 342.14
• IUPAC Name: N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide
• SMILES: O=C(Cc1cccs1)N[C@@H]1CCc2c(ccc(=O)n2CC2CC2)C1
• InChI: InChI=1S/C19H22N2O2S/c22-18(11-16-2-1-9-24-16)20-15-6-7-17-14(10-15)5-8-19(23)21(17)12-13-3-4-13/h1-2,5,8-9,13,15H,3-4,6-7,10-12H2,(H,20,22)/t15-/m1/s1
• InChIKey: FWLKAPKRZVPFCH-OAHLLOKOSA-N
• XLogP: 2.54
• TPSA: 51.10 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	342.46
LogP ≤ 5	2.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide?

The IUPAC name of N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide (CID 97389978) is N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide.

What is the SMILES notation for N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide?

The canonical SMILES for N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)N[C@@H]1CCc2c(ccc(=O)n2CC2CC2)C1.

What is the InChIKey of N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide?

The InChIKey is FWLKAPKRZVPFCH-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H22N2O2S/c22-18(11-16-2-1-9-24-16)20-15-6-7-17-14(10-15)5-8-19(23)21(17)12-13-3-4-13/h1-2,5,8-9,13,15H,3-4,6-7,10-12H2,(H,20,22)/t15-/m1/s1.

What are the key properties of N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide?

N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide has a molecular weight of 342.46 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(6R)-1-(cyclopropylmethyl)-2-oxo-5,6,7,8-tetrahydroquinolin-6-yl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 97389978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).