4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide

C14H16N2O2 — CID 123973953

IUPAC4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide
SMILESCc1noc(-c2ccccc2)c1CCCC(N)=O
InChIInChI=1S/C14H16N2O2/c1-10-12(8-5-9-13(15)17)14(18-16-10)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3,(H2,15,17)
InChIKeyMFLXHFOUQUHXEB-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.46
Rot. Bonds5

About 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide

4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide (PubChem CID 123973953) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide.

Molecular Properties

Compound Name4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide
PubChem CID123973953
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide
SMILESCc1noc(-c2ccccc2)c1CCCC(N)=O
InChIInChI=1S/C14H16N2O2/c1-10-12(8-5-9-13(15)17)14(18-16-10)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3,(H2,15,17)
InChIKeyMFLXHFOUQUHXEB-UHFFFAOYSA-N
XLogP2.46
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[5-(4-methoxyphenyl)-3-methyl-1,2-oxazol-4-yl]propanoic acid
CID 82302127
4-benzyl-3-methyl-5-phenyl-1,2-oxazole
CID 14978502
3-[5-(2-methoxyphenyl)-3-methyl-1,2-oxazol-4-yl]propanoic acid
CID 82302130
N-[4-(diethoxyphosphorylmethyl)phenyl]-3-(3-methyl-5-phenyl-1,2-oxazol-4-yl)propanamide
CID 86591382
N'-(3-methyl-5-phenyl-1,2-oxazol-4-yl)oxamide
CID 119043716
2-methyl-N-[[3-methyl-5-(4-phenylphenyl)-1,2-oxazol-4-yl]methyl]-2-phenylpropanamide
CID 141296063
3-(3,5-diphenyl-1,2-oxazol-4-yl)-N-hydroxypropanamide
CID 155384809
4-[4-[3-methyl-4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1,2-oxazol-5-yl]phenyl]benzoic acid
CID 148935050
ethyl 1-[4-[4-[4-[3-(N-ethylanilino)-3-oxopropyl]-3-methyl-1,2-oxazol-5-yl]phenyl]phenyl]cyclopropane-1-carboxylate
CID 66578752
[3-methyl-5-(4-phenylphenyl)-1,2-oxazol-4-yl]methyl N-cyclopentylcarbamate
CID 141295959
3-[3-fluoro-5-methyl-4-[(3-methyl-5-phenyl-1,2-oxazol-4-yl)methoxy]phenyl]propanoic acid
CID 67357271
2-(3-phenyl-2,1-benzoxazol-7-yl)acetamide
CID 14835400

Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide?
The IUPAC name of 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide (CID 123973953) is 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide.
What is the SMILES notation for 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide?
The canonical SMILES for 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide is Cc1noc(-c2ccccc2)c1CCCC(N)=O.
What is the InChIKey of 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide?
The InChIKey is MFLXHFOUQUHXEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-12(8-5-9-13(15)17)14(18-16-10)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3,(H2,15,17).
What are the key properties of 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide?
4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide has a molecular weight of 244.29 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-5-phenyl-1,2-oxazol-4-yl)butanamide is sourced from PubChem (CID 123973953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).