3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide

C25H20N6O2 — CID 24595395

IUPAC3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide
SMILESO=C(CCc1nc(-c2ccccc2)c(-c2ccccc2)o1)Nc1ccc(-n2cnnn2)cc1
InChIInChI=1S/C25H20N6O2/c32-22(27-20-11-13-21(14-12-20)31-17-26-29-30-31)15-16-23-28-24(18-7-3-1-4-8-18)25(33-23)19-9-5-2-6-10-19/h1-14,17H,15-16H2,(H,27,32)
InChIKeyAEMHUDRZEYYCOV-UHFFFAOYSA-N
MW436.48 g/mol
LogP4.56
Rot. Bonds7

About 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide

3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide (PubChem CID 24595395) has the molecular formula C25H20N6O2 and a molecular weight of 436.48 g/mol. Its IUPAC name is 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide.

Molecular Properties

Compound Name3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide
PubChem CID24595395
Molecular FormulaC25H20N6O2
Molecular Weight436.48 g/mol
Exact Mass436.16
IUPAC Name3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide
SMILESO=C(CCc1nc(-c2ccccc2)c(-c2ccccc2)o1)Nc1ccc(-n2cnnn2)cc1
InChIInChI=1S/C25H20N6O2/c32-22(27-20-11-13-21(14-12-20)31-17-26-29-30-31)15-16-23-28-24(18-7-3-1-4-8-18)25(33-23)19-9-5-2-6-10-19/h1-14,17H,15-16H2,(H,27,32)
InChIKeyAEMHUDRZEYYCOV-UHFFFAOYSA-N
XLogP4.56
TPSA98.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.48
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]phenyl]propanamide
CID 99172831
N-(3,4-dimethoxyphenyl)-3-(4,5-diphenyl-1,3-oxazol-2-yl)propanamide
CID 18271983
3-chloro-N-[4-(tetrazol-1-yl)phenyl]propanamide
CID 43167870
3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-(3-methoxyphenyl)propanamide
CID 18204988
3-(4,5-diphenyl-1,3-oxazol-2-yl)propanoic acid
CID 4614
3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[3-(methylaminomethyl)phenyl]propanamide
CID 171679462
5-bromo-N-[4-(tetrazol-1-yl)phenyl]pentanamide
CID 114014593
3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-(1,3-thiazol-2-yl)propanamide
CID 4904052
zinc;bis(3-(4,5-diphenyl-1,3-oxazol-2-yl)propanoate);dihydrate
CID 71477488
2-(2-chlorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 8006243
N-[4-(tetrazol-1-yl)phenyl]hexanamide
CID 18083677
N-(2,4-difluorophenyl)-3-(4,5-diphenyl-1,3-oxazol-2-yl)propanamide
CID 43038655

Frequently Asked Questions

What is the IUPAC name of 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide?
The IUPAC name of 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide (CID 24595395) is 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide.
What is the SMILES notation for 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide?
The canonical SMILES for 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide is O=C(CCc1nc(-c2ccccc2)c(-c2ccccc2)o1)Nc1ccc(-n2cnnn2)cc1.
What is the InChIKey of 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide?
The InChIKey is AEMHUDRZEYYCOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N6O2/c32-22(27-20-11-13-21(14-12-20)31-17-26-29-30-31)15-16-23-28-24(18-7-3-1-4-8-18)25(33-23)19-9-5-2-6-10-19/h1-14,17H,15-16H2,(H,27,32).
What are the key properties of 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide?
3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide has a molecular weight of 436.48 g/mol, XLogP of 4.56, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-diphenyl-1,3-oxazol-2-yl)-N-[4-(tetrazol-1-yl)phenyl]propanamide is sourced from PubChem (CID 24595395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).