N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide

C20H20N2O2 — CID 133150056

IUPACN-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
SMILESCCC(C)NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1
InChIInChI=1S/C20H20N2O2/c1-3-14(2)22-19(23)16-11-7-8-12-17(16)20-21-13-18(24-20)15-9-5-4-6-10-15/h4-14H,3H2,1-2H3,(H,22,23)
InChIKeyKRAVWYWQXXRNLZ-UHFFFAOYSA-N
MW320.39 g/mol
LogP4.54
Rot. Bonds5

About N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide

N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide (PubChem CID 133150056) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide.

Molecular Properties

Compound NameN-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
PubChem CID133150056
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC NameN-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
SMILESCCC(C)NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1
InChIInChI=1S/C20H20N2O2/c1-3-14(2)22-19(23)16-11-7-8-12-17(16)20-21-13-18(24-20)15-9-5-4-6-10-15/h4-14H,3H2,1-2H3,(H,22,23)
InChIKeyKRAVWYWQXXRNLZ-UHFFFAOYSA-N
XLogP4.54
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N-[(2R)-butan-2-yl]benzamide
CID 100508690
N-butan-2-yl-2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]benzamide
CID 133150062
N-butan-2-yl-2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]benzamide
CID 42945534
2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N-[(2R)-pentan-2-yl]benzamide
CID 100510062
2-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]-N-[(2R)-pentan-2-yl]benzamide
CID 100503337
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 100506520
2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 100510298
2-[5-(3-bromophenyl)-1,3-oxazol-2-yl]-N-pentan-2-ylbenzamide
CID 133159870
2-(5-phenyl-1,3-oxazol-2-yl)-N-propylbenzamide
CID 24654497
2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N-(1-methoxypropan-2-yl)benzamide
CID 133150117
2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-[(2R)-pentan-2-yl]benzamide
CID 100501410
2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]-N-[(2S)-pentan-2-yl]benzamide
CID 100501417

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The IUPAC name of N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide (CID 133150056) is N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide.
What is the SMILES notation for N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The canonical SMILES for N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide is CCC(C)NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1.
What is the InChIKey of N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
The InChIKey is KRAVWYWQXXRNLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-3-14(2)22-19(23)16-11-7-8-12-17(16)20-21-13-18(24-20)15-9-5-4-6-10-15/h4-14H,3H2,1-2H3,(H,22,23).
What are the key properties of N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide?
N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide has a molecular weight of 320.39 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-(5-phenyl-1,3-oxazol-2-yl)benzamide is sourced from PubChem (CID 133150056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).