N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide

C20H16N4O3 — CID 90149411

IUPACN-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide
SMILESCOc1cccc(-c2ncc(-c3ccc(NC(=O)c4cocn4)cc3)[nH]2)c1
InChIInChI=1S/C20H16N4O3/c1-26-16-4-2-3-14(9-16)19-21-10-17(24-19)13-5-7-15(8-6-13)23-20(25)18-11-27-12-22-18/h2-12H,1H3,(H,21,24)(H,23,25)
InChIKeyCVEAERRSRQKDCI-UHFFFAOYSA-N
MW360.37 g/mol
LogP3.99
Rot. Bonds5

About N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide

N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide (PubChem CID 90149411) has the molecular formula C20H16N4O3 and a molecular weight of 360.37 g/mol. Its IUPAC name is N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide
PubChem CID90149411
Molecular FormulaC20H16N4O3
Molecular Weight360.37 g/mol
Exact Mass360.12
IUPAC NameN-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide
SMILESCOc1cccc(-c2ncc(-c3ccc(NC(=O)c4cocn4)cc3)[nH]2)c1
InChIInChI=1S/C20H16N4O3/c1-26-16-4-2-3-14(9-16)19-21-10-17(24-19)13-5-7-15(8-6-13)23-20(25)18-11-27-12-22-18/h2-12H,1H3,(H,21,24)(H,23,25)
InChIKeyCVEAERRSRQKDCI-UHFFFAOYSA-N
XLogP3.99
TPSA93.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.37
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-1,3-oxazole-4-carboxamide
CID 110689577
5-chloro-2-fluoro-N-[[4-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]phenyl]methyl]benzamide
CID 46089767
5-(3-methoxyphenyl)-N-[4-(1,3-thiazol-2-yl)phenyl]-1,2-oxazole-3-carboxamide
CID 110313569
5-(3-methoxyphenyl)-N-(4-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 20963629
2-[4-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]phenyl]-1-(1,3-thiazol-4-yl)ethanone
CID 157315843
N-(4-aminophenyl)-1,3-oxazole-4-carboxamide
CID 22612942
3-methoxy-N-[4-(1H-pyrazol-5-yl)phenyl]benzamide
CID 38779477
N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104640036
1-tert-butyl-N-[4-[6-(3-methoxyphenyl)-2-pyridinyl]phenyl]-5-methylpyrazole-3-carboxamide
CID 46090692
N-[4-[5-[3-[2-[4-(3,3-dimethylbutanoylamino)phenyl]-1H-imidazol-5-yl]phenyl]-1H-imidazol-2-yl]phenyl]-3,3-dimethylbutanamide
CID 144664678
N-(4-chlorophenyl)-6-(3-methoxyphenyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 42690070
N-(1,3-benzodioxol-5-yl)-5-(3-methoxyphenyl)-1,2-oxazole-3-carboxamide
CID 3604841

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide?
The IUPAC name of N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide (CID 90149411) is N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide is COc1cccc(-c2ncc(-c3ccc(NC(=O)c4cocn4)cc3)[nH]2)c1.
What is the InChIKey of N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide?
The InChIKey is CVEAERRSRQKDCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O3/c1-26-16-4-2-3-14(9-16)19-21-10-17(24-19)13-5-7-15(8-6-13)23-20(25)18-11-27-12-22-18/h2-12H,1H3,(H,21,24)(H,23,25).
What are the key properties of N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide?
N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide has a molecular weight of 360.37 g/mol, XLogP of 3.99, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(3-methoxyphenyl)-1H-imidazol-5-yl]phenyl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 90149411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).