6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide

C17H16ClN3O3 — CID 95847945

IUPAC6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide
SMILESNC(=O)c1ccc([C@@H]2CN(C(=O)c3ccc(Cl)cc3)CCO2)nc1
InChIInChI=1S/C17H16ClN3O3/c18-13-4-1-11(2-5-13)17(23)21-7-8-24-15(10-21)14-6-3-12(9-20-14)16(19)22/h1-6,9,15H,7-8,10H2,(H2,19,22)/t15-/m0/s1
InChIKeyMHZWHTVPBVKUHY-HNNXBMFYSA-N
MW345.79 g/mol
LogP2.05
Rot. Bonds3

About 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide

6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide (PubChem CID 95847945) has the molecular formula C17H16ClN3O3 and a molecular weight of 345.79 g/mol. Its IUPAC name is 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide
PubChem CID95847945
Molecular FormulaC17H16ClN3O3
Molecular Weight345.79 g/mol
Exact Mass345.09
IUPAC Name6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide
SMILESNC(=O)c1ccc([C@@H]2CN(C(=O)c3ccc(Cl)cc3)CCO2)nc1
InChIInChI=1S/C17H16ClN3O3/c18-13-4-1-11(2-5-13)17(23)21-7-8-24-15(10-21)14-6-3-12(9-20-14)16(19)22/h1-6,9,15H,7-8,10H2,(H2,19,22)/t15-/m0/s1
InChIKeyMHZWHTVPBVKUHY-HNNXBMFYSA-N
XLogP2.05
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.79
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2S)-4-(oxane-4-carbonyl)morpholin-2-yl]pyridine-3-carboxamide
CID 95847907
[(2R)-2-(4-chlorophenyl)morpholin-4-yl]-(2-methoxypyrimidin-5-yl)methanone
CID 95197408
6-(4-pyrimidin-2-ylmorpholin-2-yl)pyridine-3-carboxamide
CID 110269000
(4-chlorophenyl)-[2-(2-fluorophenyl)morpholin-4-yl]methanone
CID 110326668
6-[(2R)-oxolan-2-yl]pyridine-3-carboxamide
CID 135030167
(4-chlorophenyl)-[2-(2,4-dichloro-5-fluorophenyl)morpholin-4-yl]methanone
CID 155946524
4-[6-[(2R)-4-(4-fluorobenzoyl)morpholin-2-yl]-2-pyridinyl]benzamide
CID 124951465
4-[6-[(2S)-4-(4-fluorobenzoyl)morpholin-2-yl]-2-pyridinyl]benzamide
CID 124951464
pyridin-4-yl-(2-pyridin-2-ylmorpholin-4-yl)methanone
CID 110270765
(6-amino-3-pyridinyl)-[(2R)-2-[5-[2-(4-chlorophenoxy)ethyl]-1H-pyrazol-3-yl]morpholin-4-yl]methanone
CID 125004502
(4-fluorophenyl)-[(2R)-2-pyridin-2-ylmorpholin-4-yl]methanone
CID 95844813
(6-amino-3-pyridinyl)-[2-[5-[(2-chlorophenyl)methyl]-2-pyridinyl]morpholin-4-yl]methanone
CID 127250252

Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide?
The IUPAC name of 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide (CID 95847945) is 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide?
The canonical SMILES for 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide is NC(=O)c1ccc([C@@H]2CN(C(=O)c3ccc(Cl)cc3)CCO2)nc1.
What is the InChIKey of 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide?
The InChIKey is MHZWHTVPBVKUHY-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H16ClN3O3/c18-13-4-1-11(2-5-13)17(23)21-7-8-24-15(10-21)14-6-3-12(9-20-14)16(19)22/h1-6,9,15H,7-8,10H2,(H2,19,22)/t15-/m0/s1.
What are the key properties of 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide?
6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide has a molecular weight of 345.79 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-4-(4-chlorobenzoyl)morpholin-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 95847945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).