3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide

C24H22N2O5 — CID 16867378

IUPAC3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide
SMILESCOc1cc(C(=O)NCc2cc(-c3ccc4ccccc4c3)on2)cc(OC)c1OC
InChIInChI=1S/C24H22N2O5/c1-28-21-11-18(12-22(29-2)23(21)30-3)24(27)25-14-19-13-20(31-26-19)17-9-8-15-6-4-5-7-16(15)10-17/h4-13H,14H2,1-3H3,(H,25,27)
InChIKeyLPVVLGFMXXHHAP-UHFFFAOYSA-N
MW418.45 g/mol
LogP4.45
Rot. Bonds7

About 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide

3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide (PubChem CID 16867378) has the molecular formula C24H22N2O5 and a molecular weight of 418.45 g/mol. Its IUPAC name is 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide.

Molecular Properties

Compound Name3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide
PubChem CID16867378
Molecular FormulaC24H22N2O5
Molecular Weight418.45 g/mol
Exact Mass418.15
IUPAC Name3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide
SMILESCOc1cc(C(=O)NCc2cc(-c3ccc4ccccc4c3)on2)cc(OC)c1OC
InChIInChI=1S/C24H22N2O5/c1-28-21-11-18(12-22(29-2)23(21)30-3)24(27)25-14-19-13-20(31-26-19)17-9-8-15-6-4-5-7-16(15)10-17/h4-13H,14H2,1-3H3,(H,25,27)
InChIKeyLPVVLGFMXXHHAP-UHFFFAOYSA-N
XLogP4.45
TPSA82.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.45
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3,4,5-trimethoxy-N-[[5-(4-phenylphenyl)-1,2-oxazol-3-yl]methyl]benzamide
CID 16867498
N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]naphthalene-2-carboxamide
CID 16867283
N-[[5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl]-3,4,5-trimethoxybenzamide
CID 16866743
4-tert-butyl-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide
CID 16867364
3,4,5-trimethoxy-N-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl]benzamide
CID 23613096
3,4,5-trimethoxy-N-[(5-methyl-1,2-oxazol-3-yl)methyl]benzamide
CID 47728397
N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-naphthalen-2-yloxyacetamide
CID 16867168
N-[(3,4,5-trimethoxyphenyl)methyl]naphthalene-2-carboxamide
CID 41261586
4-methoxy-N-[[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl]benzamide
CID 16866986
4-methoxy-N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]benzamide
CID 16866605
3,4,5-triethoxy-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]benzamide
CID 16866490
N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]-4-piperidin-1-ylsulfonylbenzamide
CID 16867447

Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide?
The IUPAC name of 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide (CID 16867378) is 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide.
What is the SMILES notation for 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide?
The canonical SMILES for 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide is COc1cc(C(=O)NCc2cc(-c3ccc4ccccc4c3)on2)cc(OC)c1OC.
What is the InChIKey of 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide?
The InChIKey is LPVVLGFMXXHHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O5/c1-28-21-11-18(12-22(29-2)23(21)30-3)24(27)25-14-19-13-20(31-26-19)17-9-8-15-6-4-5-7-16(15)10-17/h4-13H,14H2,1-3H3,(H,25,27).
What are the key properties of 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide?
3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide has a molecular weight of 418.45 g/mol, XLogP of 4.45, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethoxy-N-[(5-naphthalen-2-yl-1,2-oxazol-3-yl)methyl]benzamide is sourced from PubChem (CID 16867378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).