N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide

C17H19N3O4 — CID 6723977

IUPACN-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide
SMILESO=C(N[C@@H](CO)C(=O)N1CCOCC1)c1ccc2ccccc2n1
InChIInChI=1S/C17H19N3O4/c21-11-15(17(23)20-7-9-24-10-8-20)19-16(22)14-6-5-12-3-1-2-4-13(12)18-14/h1-6,15,21H,7-11H2,(H,19,22)/t15-/m0/s1
InChIKeyQGVGBFBWHGMGHQ-HNNXBMFYSA-N
MW329.36 g/mol
LogP0.18
Rot. Bonds4

About N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide

N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide (PubChem CID 6723977) has the molecular formula C17H19N3O4 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide
PubChem CID6723977
Molecular FormulaC17H19N3O4
Molecular Weight329.36 g/mol
Exact Mass329.14
IUPAC NameN-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide
SMILESO=C(N[C@@H](CO)C(=O)N1CCOCC1)c1ccc2ccccc2n1
InChIInChI=1S/C17H19N3O4/c21-11-15(17(23)20-7-9-24-10-8-20)19-16(22)14-6-5-12-3-1-2-4-13(12)18-14/h1-6,15,21H,7-11H2,(H,19,22)/t15-/m0/s1
InChIKeyQGVGBFBWHGMGHQ-HNNXBMFYSA-N
XLogP0.18
TPSA91.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide with MolForge

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Related Compounds

N-[(2S)-1-[4-(4-acetylphenyl)piperazin-1-yl]-3-hydroxy-1-oxopropan-2-yl]quinoline-2-carboxamide
CID 6724000
N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]benzamide
CID 6724167
N-(3-morpholin-4-yl-3-oxopropyl)quinoline-2-carboxamide
CID 46598471
N-[3-hydroxy-1-(morpholin-4-ylamino)-1-oxopropan-2-yl]quinoxaline-2-carboxamide
CID 3494740
N-[3-hydroxy-1-oxo-1-(1,2,4-triazol-4-ylamino)propan-2-yl]quinoline-2-carboxamide
CID 3420478
N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]-2-naphthalen-1-ylacetamide
CID 6724203
N-[(2S)-3-hydroxy-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl]quinoxaline-2-carboxamide
CID 6723497
N-[1-(1,3-benzodioxol-5-ylmethylamino)-3-hydroxy-1-oxopropan-2-yl]quinoline-2-carboxamide
CID 4258209
N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]-2-pyridin-4-ylacetamide
CID 6724737
N-[(2S)-3-hydroxy-1-oxo-1-[[4-(trifluoromethyl)phenyl]methylamino]propan-2-yl]quinoline-2-carboxamide
CID 6723979
N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]quinoline-2-carboxamide
CID 9148328
(2S)-2-(quinoline-2-carbonylamino)pentanoic acid
CID 107564261

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide?
The IUPAC name of N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide (CID 6723977) is N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide.
What is the SMILES notation for N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide?
The canonical SMILES for N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide is O=C(N[C@@H](CO)C(=O)N1CCOCC1)c1ccc2ccccc2n1.
What is the InChIKey of N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide?
The InChIKey is QGVGBFBWHGMGHQ-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H19N3O4/c21-11-15(17(23)20-7-9-24-10-8-20)19-16(22)14-6-5-12-3-1-2-4-13(12)18-14/h1-6,15,21H,7-11H2,(H,19,22)/t15-/m0/s1.
What are the key properties of N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide?
N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-3-hydroxy-1-morpholin-4-yl-1-oxopropan-2-yl]quinoline-2-carboxamide is sourced from PubChem (CID 6723977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).