N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide

C20H15N3O2 — CID 7708593

IUPACN-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide
SMILESCc1ccc(-c2nonc2NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C20H15N3O2/c1-13-9-11-15(12-10-13)18-19(23-25-22-18)21-20(24)17-8-4-6-14-5-2-3-7-16(14)17/h2-12H,1H3,(H,21,23,24)
InChIKeyMJXNLWWLOBOCCT-UHFFFAOYSA-N
MW329.36 g/mol
LogP4.45
Rot. Bonds3

About N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide

N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide (PubChem CID 7708593) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide
PubChem CID7708593
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC NameN-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide
SMILESCc1ccc(-c2nonc2NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C20H15N3O2/c1-13-9-11-15(12-10-13)18-19(23-25-22-18)21-20(24)17-8-4-6-14-5-2-3-7-16(14)17/h2-12H,1H3,(H,21,23,24)
InChIKeyMJXNLWWLOBOCCT-UHFFFAOYSA-N
XLogP4.45
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide 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

N-[4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide
CID 19244629
N-[4-(4-fluorophenyl)-1,2,5-oxadiazol-3-yl]-2-methoxybenzamide
CID 7710203
N-(5-methyl-2-pyridinyl)naphthalene-1-carboxamide
CID 673887
1-methyl-N-(4-methyl-1,2,5-oxadiazol-3-yl)naphthalene-2-carboxamide
CID 157460786
N-[4-(2,5-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-2-methylbenzamide
CID 19244494
benzene;tris(N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]-2-methoxybenzamide)
CID 175653128
N-[4-(4-chlorophenyl)-1,2,5-oxadiazol-3-yl]-2-propoxybenzamide
CID 7677392
2-butoxy-N-[4-(4-fluorophenyl)-1,2,5-oxadiazol-3-yl]benzamide
CID 7709712
N-(2,5-dimethylphenyl)naphthalene-1-carboxamide
CID 1278696
4-bromo-2,6-difluoro-N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]benzamide
CID 154793756
N-(4,6-dimethylpyrimidin-2-yl)naphthalene-1-carboxamide
CID 966576
N-[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]naphthalene-1-carboxamide
CID 3100050

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide?
The IUPAC name of N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide (CID 7708593) is N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide?
The canonical SMILES for N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide is Cc1ccc(-c2nonc2NC(=O)c2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide?
The InChIKey is MJXNLWWLOBOCCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c1-13-9-11-15(12-10-13)18-19(23-25-22-18)21-20(24)17-8-4-6-14-5-2-3-7-16(14)17/h2-12H,1H3,(H,21,23,24).
What are the key properties of N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide?
N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 4.45, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]naphthalene-1-carboxamide is sourced from PubChem (CID 7708593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).