N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide

C18H16N2O3 — CID 58833396

IUPACN-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide
SMILESO=C(NCCO)c1ccc(-c2conc2-c2ccccc2)cc1
InChIInChI=1S/C18H16N2O3/c21-11-10-19-18(22)15-8-6-13(7-9-15)16-12-23-20-17(16)14-4-2-1-3-5-14/h1-9,12,21H,10-11H2,(H,19,22)
InChIKeyFWBKSNJBPBXLFW-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.73
Rot. Bonds5

About N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide

N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide (PubChem CID 58833396) has the molecular formula C18H16N2O3 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide
PubChem CID58833396
Molecular FormulaC18H16N2O3
Molecular Weight308.34 g/mol
Exact Mass308.12
IUPAC NameN-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide
SMILESO=C(NCCO)c1ccc(-c2conc2-c2ccccc2)cc1
InChIInChI=1S/C18H16N2O3/c21-11-10-19-18(22)15-8-6-13(7-9-15)16-12-23-20-17(16)14-4-2-1-3-5-14/h1-9,12,21H,10-11H2,(H,19,22)
InChIKeyFWBKSNJBPBXLFW-UHFFFAOYSA-N
XLogP2.73
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(4-phenyl-1,2-oxazole-3-carbonyl)amino]ethyl]carbamate
CID 19768618
N-(3-methylbutyl)-3-phenyl-1,2-oxazole-4-carboxamide
CID 100772034
ethane;N-[4-(3-phenyl-1,2-oxazol-4-yl)phenyl]sulfanylpropanamide
CID 142891124
benzoic acid;N-(2-hydroxyethyl)benzamide
CID 68510330
3-phenyl-N-(2-phenylethyl)-1,2-oxazole-4-carboxamide
CID 100771698
3-[4-(fluoromethyl)phenyl]-1,2,4-oxadiazole;N-(2-hydroxyethyl)benzamide
CID 145159457
[4-[5-[4-(2-hydroxyethylcarbamoyl)phenyl]-3-phenyl-1,6-naphthyridin-2-yl]phenyl]methylazanium
CID 58524736
N-(2-hydroxyethyl)-3-(2-phenyl-1,3-thiazol-4-yl)-1,2-benzoxazole-5-carboxamide
CID 97361925
tert-butyl-[2-[(4-phenyl-1,2-oxazole-3-carbonyl)amino]ethyl]carbamic acid
CID 70365205
N-[5-(diaminomethylideneamino)pentyl]-4-phenyl-1,2-oxazole-3-carboxamide
CID 171108414
2-[[4-(3-fluorophenyl)-1,2-oxazole-3-carbonyl]amino]ethylcarbamic acid
CID 19768597
N-butyl-4-phenylbenzamide
CID 3637649

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide?
The IUPAC name of N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide (CID 58833396) is N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide.
What is the SMILES notation for N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide?
The canonical SMILES for N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide is O=C(NCCO)c1ccc(-c2conc2-c2ccccc2)cc1.
What is the InChIKey of N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide?
The InChIKey is FWBKSNJBPBXLFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3/c21-11-10-19-18(22)15-8-6-13(7-9-15)16-12-23-20-17(16)14-4-2-1-3-5-14/h1-9,12,21H,10-11H2,(H,19,22).
What are the key properties of N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide?
N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide has a molecular weight of 308.34 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-4-(3-phenyl-1,2-oxazol-4-yl)benzamide is sourced from PubChem (CID 58833396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).