N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide

C22H24N2O3 — CID 112827996

IUPACN,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide
SMILESCN(C(=O)C(C)(C)C)c1ccc(OCc2cc(-c3ccccc3)on2)cc1
InChIInChI=1S/C22H24N2O3/c1-22(2,3)21(25)24(4)18-10-12-19(13-11-18)26-15-17-14-20(27-23-17)16-8-6-5-7-9-16/h5-14H,15H2,1-4H3
InChIKeyVTILUXFLESBXMU-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.93
Rot. Bonds5

About N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide

N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide (PubChem CID 112827996) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide
PubChem CID112827996
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC NameN,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide
SMILESCN(C(=O)C(C)(C)C)c1ccc(OCc2cc(-c3ccccc3)on2)cc1
InChIInChI=1S/C22H24N2O3/c1-22(2,3)21(25)24(4)18-10-12-19(13-11-18)26-15-17-14-20(27-23-17)16-8-6-5-7-9-16/h5-14H,15H2,1-4H3
InChIKeyVTILUXFLESBXMU-UHFFFAOYSA-N
XLogP4.93
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-1-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]-3-propan-2-ylurea
CID 60522595
(5-phenyl-1,2-oxazol-3-yl)methyl 2-methyl-2-phenylpropanoate
CID 8568214
[4-[2,2-dimethylpropanoyl(methyl)amino]phenyl] 3-(1,3-thiazol-4-ylmethoxy)benzoate
CID 86911740
N-[4-[(3-fluorophenyl)methoxy]phenyl]-N,2,2-trimethylpropanamide
CID 112828000
(5-phenyl-1,2-oxazol-3-yl)methyl 2-hydroxy-2,2-diphenylacetate
CID 8579182
methyl (4E)-4-phenyl-4-[[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]methoxyimino]butanoate
CID 11730378
4-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]benzoic acid
CID 43214757
3-[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]propanoic acid
CID 60988202
2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]-N-methyl-N-phenylacetamide
CID 16878802
N-(4-ethoxyphenyl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 16878327
[4-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]-phenylmethanone
CID 9137989
[5-(4-phenylmethoxyphenyl)-1,2-oxazol-3-yl]methanethiol
CID 165479755

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide?
The IUPAC name of N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide (CID 112827996) is N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide.
What is the SMILES notation for N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide?
The canonical SMILES for N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide is CN(C(=O)C(C)(C)C)c1ccc(OCc2cc(-c3ccccc3)on2)cc1.
What is the InChIKey of N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide?
The InChIKey is VTILUXFLESBXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-22(2,3)21(25)24(4)18-10-12-19(13-11-18)26-15-17-14-20(27-23-17)16-8-6-5-7-9-16/h5-14H,15H2,1-4H3.
What are the key properties of N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide?
N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide has a molecular weight of 364.45 g/mol, XLogP of 4.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-N-[4-[(5-phenyl-1,2-oxazol-3-yl)methoxy]phenyl]propanamide is sourced from PubChem (CID 112827996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).