N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide

C19H27N3O3 — CID 94116546

About N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide

N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide (PubChem CID 94116546) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide.

Molecular Properties

• Compound Name: N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide
• PubChem CID: 94116546
• Molecular Formula: C19H27N3O3
• Molecular Weight: 345.44 g/mol
• Exact Mass: 345.21
• IUPAC Name: N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide
• SMILES: C[C@@H](CN1CCOCC1)NC(=O)CC[C@@H]1Cc2ccccc2NC1=O
• InChI: InChI=1S/C19H27N3O3/c1-14(13-22-8-10-25-11-9-22)20-18(23)7-6-16-12-15-4-2-3-5-17(15)21-19(16)24/h2-5,14,16H,6-13H2,1H3,(H,20,23)(H,21,24)/t14-,16+/m0/s1
• InChIKey: VIALJKVPZDLZCH-GOEBONIOSA-N
• XLogP: 1.41
• TPSA: 70.67 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 4
• Rotatable Bonds: 6
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	345.44
LogP ≤ 5	1.41
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide?

The IUPAC name of N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide (CID 94116546) is N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide.

What is the SMILES notation for N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide?

The canonical SMILES for N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide is C[C@@H](CN1CCOCC1)NC(=O)CC[C@@H]1Cc2ccccc2NC1=O.

What is the InChIKey of N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide?

The InChIKey is VIALJKVPZDLZCH-GOEBONIOSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-14(13-22-8-10-25-11-9-22)20-18(23)7-6-16-12-15-4-2-3-5-17(15)21-19(16)24/h2-5,14,16H,6-13H2,1H3,(H,20,23)(H,21,24)/t14-,16+/m0/s1.

What are the key properties of N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide?

N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide has a molecular weight of 345.44 g/mol, XLogP of 1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2S)-1-morpholin-4-ylpropan-2-yl]-3-[(3R)-2-oxo-3,4-dihydro-1H-quinolin-3-yl]propanamide is sourced from PubChem (CID 94116546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).