5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide

C21H22N4O3 — CID 57401961

IUPAC5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide
SMILESCCc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C21H22N4O3/c1-2-17-19(24-21(28-17)15-6-4-3-5-7-15)20(26)23-16-8-9-18(22-14-16)25-10-12-27-13-11-25/h3-9,14H,2,10-13H2,1H3,(H,23,26)
InChIKeyOKFNGBSHUCUBEU-UHFFFAOYSA-N
MW378.43 g/mol
LogP3.39
Rot. Bonds5

About 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide

5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide (PubChem CID 57401961) has the molecular formula C21H22N4O3 and a molecular weight of 378.43 g/mol. Its IUPAC name is 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide
PubChem CID57401961
Molecular FormulaC21H22N4O3
Molecular Weight378.43 g/mol
Exact Mass378.17
IUPAC Name5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide
SMILESCCc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C21H22N4O3/c1-2-17-19(24-21(28-17)15-6-4-3-5-7-15)20(26)23-16-8-9-18(22-14-16)25-10-12-27-13-11-25/h3-9,14H,2,10-13H2,1H3,(H,23,26)
InChIKeyOKFNGBSHUCUBEU-UHFFFAOYSA-N
XLogP3.39
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxamide
CID 16757011
N-[6-[4-(methylamino)piperidin-1-yl]-3-pyridinyl]-2-phenyl-5-(trifluoromethyl)-1,3-oxazole-4-carboxamide;2,2,2-trifluoroacetic acid
CID 86632274
5-fluoro-2-phenyl-N-[6-(4-phenylpiperidin-1-yl)-3-pyridinyl]-1,3-oxazole-4-carboxamide
CID 70870822
2,2-dimethyl-3-[1-[5-[[2-phenyl-5-(trifluoromethyl)-1,3-oxazole-4-carbonyl]amino]-2-pyridinyl]piperidin-4-yl]propanoic acid
CID 25118299
N-(6-morpholin-4-yl-3-pyridinyl)-3-(5-phenyl-1,3,4-oxadiazol-2-yl)propanamide
CID 43041424
ethyl 4-[5-[[2-phenyl-5-(trifluoromethyl)-1,3-oxazole-4-carbonyl]amino]-2-pyridinyl]-1,4-diazepane-1-carboxylate
CID 59185671
N-(6-morpholin-4-yl-3-pyridinyl)naphthalene-2-carboxamide
CID 3975213
1-methyl-3-(6-morpholin-4-yl-3-pyridinyl)urea
CID 47162241
N-(6-morpholin-4-yl-3-pyridinyl)-2-phenylbutanamide
CID 42940174
5-chloro-2-(diethylamino)-N-(6-morpholin-4-yl-3-pyridinyl)pyrimidine-4-carboxamide
CID 48655504
3-[(6-morpholin-4-yl-3-pyridinyl)amino]-3-oxopropanoic acid
CID 62229953
2-amino-N-(6-morpholin-4-yl-3-pyridinyl)benzamide
CID 119946355

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide (CID 57401961) is 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide is CCc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide?
The InChIKey is OKFNGBSHUCUBEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O3/c1-2-17-19(24-21(28-17)15-6-4-3-5-7-15)20(26)23-16-8-9-18(22-14-16)25-10-12-27-13-11-25/h3-9,14H,2,10-13H2,1H3,(H,23,26).
What are the key properties of 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide?
5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide has a molecular weight of 378.43 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(6-morpholin-4-yl-3-pyridinyl)-2-phenyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 57401961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).