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

C25H23N3O3 — CID 57257365

IUPACN-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide
SMILESCCCCC(=O)Nc1oc(-c2ccccc2-c2cccc(O)c2)nc1-c1cccnc1
InChIInChI=1S/C25H23N3O3/c1-2-3-13-22(30)27-25-23(18-9-7-14-26-16-18)28-24(31-25)21-12-5-4-11-20(21)17-8-6-10-19(29)15-17/h4-12,14-16,29H,2-3,13H2,1H3,(H,27,30)
InChIKeyDPIMYHPLKBHVLN-UHFFFAOYSA-N
MW413.48 g/mol
LogP5.90
Rot. Bonds7

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

N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide (PubChem CID 57257365) has the molecular formula C25H23N3O3 and a molecular weight of 413.48 g/mol. Its IUPAC name is N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide.

Molecular Properties

Compound NameN-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide
PubChem CID57257365
Molecular FormulaC25H23N3O3
Molecular Weight413.48 g/mol
Exact Mass413.17
IUPAC NameN-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide
SMILESCCCCC(=O)Nc1oc(-c2ccccc2-c2cccc(O)c2)nc1-c1cccnc1
InChIInChI=1S/C25H23N3O3/c1-2-3-13-22(30)27-25-23(18-9-7-14-26-16-18)28-24(31-25)21-12-5-4-11-20(21)17-8-6-10-19(29)15-17/h4-12,14-16,29H,2-3,13H2,1H3,(H,27,30)
InChIKeyDPIMYHPLKBHVLN-UHFFFAOYSA-N
XLogP5.90
TPSA88.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500413.48
LogP ≤ 55.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[2-(3-hydroxyphenyl)phenyl]-4-[4-(trifluoromethyl)phenyl]-1,3-oxazol-5-yl]pentanamide
CID 70180403
N-[2-[2-(2-hydroxyphenyl)phenyl]-4-phenyl-1,3-oxazol-5-yl]pentanamide
CID 139917947
N-[2-[2-(2-hydroxyphenyl)phenyl]-4-(3-sulfanylphenyl)-1,3-oxazol-5-yl]pentanamide
CID 139917956
N-[2-[2-(3-hydroxyphenyl)phenyl]-4-thiophen-2-yl-1,3-oxazol-5-yl]acetamide
CID 57197415
N-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)pentanamide
CID 4621791
N-[4-(4-chlorophenyl)-2-[2-(2-hydroxyphenyl)phenyl]-1,3-oxazol-5-yl]acetamide
CID 139917864
N-[4-(3-chlorophenyl)-2-(2-hydroxy-4-naphthalen-1-ylphenyl)-1,3-oxazol-5-yl]acetamide
CID 139918012
N-[4-(4-chlorophenyl)-2-(2-hydroxy-4-naphthalen-1-ylphenyl)-1,3-oxazol-5-yl]acetamide
CID 139917966
N-[5-[3-(4-pyridin-3-yl-1H-benzimidazol-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-3-pyridinyl]pentanamide
CID 137057343
3-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)phenol
CID 25054362
N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]heptanamide
CID 73345816
2-(pentanoylamino)-N-pyridin-3-ylbenzamide
CID 30336770

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide?
The IUPAC name of N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide (CID 57257365) is N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide.
What is the SMILES notation for N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide?
The canonical SMILES for N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide is CCCCC(=O)Nc1oc(-c2ccccc2-c2cccc(O)c2)nc1-c1cccnc1.
What is the InChIKey of N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide?
The InChIKey is DPIMYHPLKBHVLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O3/c1-2-3-13-22(30)27-25-23(18-9-7-14-26-16-18)28-24(31-25)21-12-5-4-11-20(21)17-8-6-10-19(29)15-17/h4-12,14-16,29H,2-3,13H2,1H3,(H,27,30).
What are the key properties of N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide?
N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide has a molecular weight of 413.48 g/mol, XLogP of 5.90, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(3-hydroxyphenyl)phenyl]-4-pyridin-3-yl-1,3-oxazol-5-yl]pentanamide is sourced from PubChem (CID 57257365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).