3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide

C19H24N2O2 — CID 99839399

IUPAC3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide
SMILESCC(C)(C)c1cnc(CCC(=O)NC/C=C/c2ccccc2)o1
InChIInChI=1S/C19H24N2O2/c1-19(2,3)16-14-21-18(23-16)12-11-17(22)20-13-7-10-15-8-5-4-6-9-15/h4-10,14H,11-13H2,1-3H3,(H,20,22)/b10-7+
InChIKeyKAGPFHFRTIHADI-JXMROGBWSA-N
MW312.41 g/mol
LogP3.73
Rot. Bonds6

About 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide

3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide (PubChem CID 99839399) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide.

Molecular Properties

Compound Name3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide
PubChem CID99839399
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide
SMILESCC(C)(C)c1cnc(CCC(=O)NC/C=C/c2ccccc2)o1
InChIInChI=1S/C19H24N2O2/c1-19(2,3)16-14-21-18(23-16)12-11-17(22)20-13-7-10-15-8-5-4-6-9-15/h4-10,14H,11-13H2,1-3H3,(H,20,22)/b10-7+
InChIKeyKAGPFHFRTIHADI-JXMROGBWSA-N
XLogP3.73
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-phenylprop-2-enyl)hexanamide
CID 54485378
4-[3-[(5-tert-butyl-1,3-oxazol-2-yl)methylamino]-3-oxopropyl]benzoic acid
CID 119185478
3-methylsulfonyl-N-[(E)-3-phenylprop-2-enyl]propanamide
CID 75407300
methyl 8-oxo-8-(3-phenylprop-2-enylamino)octanoate
CID 66958561
N-[[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-3-(5-tert-butyl-1,3-oxazol-2-yl)propanamide
CID 100627632
N-(2-hydroxy-2,3-dimethylbutyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 111483980
4-(oxan-4-yl)-N-[(E)-3-phenylprop-2-enyl]butanamide
CID 100686451
(2-phenylphenyl) 3-(5-tert-butyl-1,3-oxazol-2-yl)propanoate
CID 100611545
N-tert-butyl-3-[[(E)-3-phenylprop-2-enyl]amino]propanamide
CID 112689881
3-(5-phenyl-1,3-oxazol-2-yl)-N-propylpropanamide
CID 18135781
3-(5-tert-butyl-1,3-oxazol-2-yl)-N-(3-tert-butyl-1-pyridin-2-ylpyrazol-5-yl)propanamide
CID 99787256
2-[[[(5-tert-butyl-1,3-oxazol-2-yl)methylamino]-(ethylamino)methylidene]amino]-N-phenylacetamide;hydroiodide
CID 111594547

Frequently Asked Questions

What is the IUPAC name of 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide?
The IUPAC name of 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide (CID 99839399) is 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide.
What is the SMILES notation for 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide?
The canonical SMILES for 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide is CC(C)(C)c1cnc(CCC(=O)NC/C=C/c2ccccc2)o1.
What is the InChIKey of 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide?
The InChIKey is KAGPFHFRTIHADI-JXMROGBWSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-19(2,3)16-14-21-18(23-16)12-11-17(22)20-13-7-10-15-8-5-4-6-9-15/h4-10,14H,11-13H2,1-3H3,(H,20,22)/b10-7+.
What are the key properties of 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide?
3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide has a molecular weight of 312.41 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-tert-butyl-1,3-oxazol-2-yl)-N-[(E)-3-phenylprop-2-enyl]propanamide is sourced from PubChem (CID 99839399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).