N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide

C18H17N3O2 — CID 162626206

IUPACN-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide
SMILESCc1nc(NC(=O)c2ncoc2C)cc(-c2ccccc2)c1C
InChIInChI=1S/C18H17N3O2/c1-11-12(2)20-16(9-15(11)14-7-5-4-6-8-14)21-18(22)17-13(3)23-10-19-17/h4-10H,1-3H3,(H,20,21,22)
InChIKeyLRMYRPQZSNZPNA-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.91
Rot. Bonds3

About N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide

N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide (PubChem CID 162626206) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide
PubChem CID162626206
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC NameN-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide
SMILESCc1nc(NC(=O)c2ncoc2C)cc(-c2ccccc2)c1C
InChIInChI=1S/C18H17N3O2/c1-11-12(2)20-16(9-15(11)14-7-5-4-6-8-14)21-18(22)17-13(3)23-10-19-17/h4-10H,1-3H3,(H,20,21,22)
InChIKeyLRMYRPQZSNZPNA-UHFFFAOYSA-N
XLogP3.91
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-4-oxo-3H-phthalazine-1-carboxamide
CID 155501513
5-methyl-N'-phenyl-1,3-oxazole-4-carbohydrazide
CID 137320310
N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-2-methoxy-5-sulfamoylbenzamide
CID 155492228
N-(2-methylphenyl)-5-phenyl-1,3-oxazole-4-carboxamide
CID 110689264
N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-2-(2-oxoazepan-1-yl)acetamide
CID 157016695
N-[5-(4-chlorophenyl)-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 56961283
N-[3-(furan-2-yl)-3-phenylpropyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 131922221
methyl (2R)-2-[(5-methyl-1,3-oxazole-4-carbonyl)amino]-2-naphthalen-2-ylacetate
CID 97350475
N-(6-oxo-5-phenyl-1H-pyridazin-3-yl)benzamide
CID 71579986
N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 569560
5-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-1,3-oxazole-4-carboxamide
CID 136579121
3-methyl-2-[(5-methyl-1,3-oxazole-4-carbonyl)amino]butanoic acid
CID 119348465

Frequently Asked Questions

What is the IUPAC name of N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide (CID 162626206) is N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide is Cc1nc(NC(=O)c2ncoc2C)cc(-c2ccccc2)c1C.
What is the InChIKey of N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide?
The InChIKey is LRMYRPQZSNZPNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-11-12(2)20-16(9-15(11)14-7-5-4-6-8-14)21-18(22)17-13(3)23-10-19-17/h4-10H,1-3H3,(H,20,21,22).
What are the key properties of N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide?
N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dimethyl-4-phenyl-2-pyridinyl)-5-methyl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 162626206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).