N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide

C26H24N2O3 — CID 139917947

IUPACN-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide
SMILESCCCCC(=O)Nc1oc(-c2ccccc2-c2ccccc2O)nc1-c1ccccc1
InChIInChI=1S/C26H24N2O3/c1-2-3-17-23(30)27-26-24(18-11-5-4-6-12-18)28-25(31-26)21-15-8-7-13-19(21)20-14-9-10-16-22(20)29/h4-16,29H,2-3,17H2,1H3,(H,27,30)
InChIKeyODGKNBPVTQVEAZ-UHFFFAOYSA-N
MW412.49 g/mol
LogP6.51
Rot. Bonds7

About N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide

N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide (PubChem CID 139917947) has the molecular formula C26H24N2O3 and a molecular weight of 412.49 g/mol. Its IUPAC name is N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide.

Molecular Properties

Compound NameN-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide
PubChem CID139917947
Molecular FormulaC26H24N2O3
Molecular Weight412.49 g/mol
Exact Mass412.18
IUPAC NameN-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide
SMILESCCCCC(=O)Nc1oc(-c2ccccc2-c2ccccc2O)nc1-c1ccccc1
InChIInChI=1S/C26H24N2O3/c1-2-3-17-23(30)27-26-24(18-11-5-4-6-12-18)28-25(31-26)21-15-8-7-13-19(21)20-14-9-10-16-22(20)29/h4-16,29H,2-3,17H2,1H3,(H,27,30)
InChIKeyODGKNBPVTQVEAZ-UHFFFAOYSA-N
XLogP6.51
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.49
LogP ≤ 56.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[2-(2-hydroxyphenyl)phenyl]-4-(3-sulfanylphenyl)-1,3-oxazol-5-yl]pentanamide
CID 139917956
N-[2-[2-(3-hydroxyphenyl)phenyl]-4-[4-(trifluoromethyl)phenyl]-1,3-oxazol-5-yl]pentanamide
CID 70180403
N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide
CID 57257365
N-[4-(4-chlorophenyl)-2-[2-(2-hydroxyphenyl)phenyl]-1,3-oxazol-5-yl]acetamide
CID 139917864
N-[4-(4-chlorophenyl)-2-(2-hydroxy-4-naphthalen-1-ylphenyl)-1,3-oxazol-5-yl]acetamide
CID 139917966
N-[4-(2-chlorophenyl)-2-phenyl-1,3-oxazol-5-yl]acetamide
CID 139917835
N-[4-(3-chlorophenyl)-2-(2-hydroxy-4-naphthalen-1-ylphenyl)-1,3-oxazol-5-yl]acetamide
CID 139918012
N-[2-[2-(3-hydroxyphenyl)phenyl]-4-(3-methoxyphenyl)-1,3-oxazol-5-yl]acetamide
CID 57224621
N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pentanamide
CID 3828486
N-(5-phenyl-2H-triazol-4-yl)heptanamide
CID 101432719
N-(2,5-diphenyltriazol-4-yl)pentanamide
CID 101457344
N-[2-[2-(3-hydroxyphenyl)phenyl]-4-thiophen-2-yl-1,3-oxazol-5-yl]acetamide
CID 57197415

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide?
The IUPAC name of N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide (CID 139917947) is N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide.
What is the SMILES notation for N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide?
The canonical SMILES for N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide is CCCCC(=O)Nc1oc(-c2ccccc2-c2ccccc2O)nc1-c1ccccc1.
What is the InChIKey of N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide?
The InChIKey is ODGKNBPVTQVEAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N2O3/c1-2-3-17-23(30)27-26-24(18-11-5-4-6-12-18)28-25(31-26)21-15-8-7-13-19(21)20-14-9-10-16-22(20)29/h4-16,29H,2-3,17H2,1H3,(H,27,30).
What are the key properties of N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide?
N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide has a molecular weight of 412.49 g/mol, XLogP of 6.51, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide is sourced from PubChem (CID 139917947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).