N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide

C22H20N4O2 — CID 22221318

IUPACN-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide
SMILESO=C(CCCc1cnoc1-c1ccccc1)Nc1ccc(-n2ccnc2)cc1
InChIInChI=1S/C22H20N4O2/c27-21(25-19-9-11-20(12-10-19)26-14-13-23-16-26)8-4-7-18-15-24-28-22(18)17-5-2-1-3-6-17/h1-3,5-6,9-16H,4,7-8H2,(H,25,27)
InChIKeyQCJIWJOERWLDJZ-UHFFFAOYSA-N
MW372.43 g/mol
LogP4.49
Rot. Bonds7

About N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide

N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide (PubChem CID 22221318) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide.

Molecular Properties

Compound NameN-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide
PubChem CID22221318
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC NameN-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide
SMILESO=C(CCCc1cnoc1-c1ccccc1)Nc1ccc(-n2ccnc2)cc1
InChIInChI=1S/C22H20N4O2/c27-21(25-19-9-11-20(12-10-19)26-14-13-23-16-26)8-4-7-18-15-24-28-22(18)17-5-2-1-3-6-17/h1-3,5-6,9-16H,4,7-8H2,(H,25,27)
InChIKeyQCJIWJOERWLDJZ-UHFFFAOYSA-N
XLogP4.49
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(dimethoxyphosphorylmethyl)phenyl]-4-(5-phenyl-1,2-oxazol-4-yl)butanamide
CID 87889786
N-[4-(diethoxyphosphorylmethyl)phenyl]-4-(5-phenyl-1,2-oxazol-4-yl)butanamide
CID 22221010
4-(5-phenyl-1,2-oxazol-4-yl)butanoic acid
CID 22221097
4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-(4-imidazol-1-ylphenyl)butanamide
CID 55670940
2-[2-(4-imidazol-1-ylanilino)-2-oxoethyl]benzoic acid
CID 56762074
N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide
CID 87039583
3-(1H-benzimidazol-2-yl)-N-(4-imidazol-1-ylphenyl)propanamide
CID 31409989
N-[4-[(2-oxo-1,3,2λ5-dioxaphosphinan-2-yl)methyl]phenyl]-3-(5-phenyl-1,2-oxazol-4-yl)propanamide
CID 87892510
N-(4-imidazol-1-ylphenyl)-3-indol-1-ylpropanamide
CID 37193450
2-(4-hydroxyphenyl)-N-(4-imidazol-1-ylphenyl)acetamide
CID 78845003
N-(4-imidazol-1-ylphenyl)-2-(2-methoxyphenyl)acetamide
CID 31409632
N-(4-imidazol-1-ylphenyl)-2-(4-methylphenyl)acetamide
CID 37194021

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide?
The IUPAC name of N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide (CID 22221318) is N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide.
What is the SMILES notation for N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide?
The canonical SMILES for N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide is O=C(CCCc1cnoc1-c1ccccc1)Nc1ccc(-n2ccnc2)cc1.
What is the InChIKey of N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide?
The InChIKey is QCJIWJOERWLDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O2/c27-21(25-19-9-11-20(12-10-19)26-14-13-23-16-26)8-4-7-18-15-24-28-22(18)17-5-2-1-3-6-17/h1-3,5-6,9-16H,4,7-8H2,(H,25,27).
What are the key properties of N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide?
N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide has a molecular weight of 372.43 g/mol, XLogP of 4.49, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazol-1-ylphenyl)-4-(5-phenyl-1,2-oxazol-4-yl)butanamide is sourced from PubChem (CID 22221318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).