N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide

C18H18N4O3 — CID 71922397

IUPACN-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(NCc2noc(C)n2)cc1
InChIInChI=1S/C18H18N4O3/c1-12-20-17(22-25-12)11-19-14-9-7-13(8-10-14)18(23)21-15-5-3-4-6-16(15)24-2/h3-10,19H,11H2,1-2H3,(H,21,23)
InChIKeyIZIDAWNMMHHOFB-UHFFFAOYSA-N
MW338.37 g/mol
LogP3.25
Rot. Bonds6

About N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide

N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide (PubChem CID 71922397) has the molecular formula C18H18N4O3 and a molecular weight of 338.37 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide
PubChem CID71922397
Molecular FormulaC18H18N4O3
Molecular Weight338.37 g/mol
Exact Mass338.14
IUPAC NameN-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(NCc2noc(C)n2)cc1
InChIInChI=1S/C18H18N4O3/c1-12-20-17(22-25-12)11-19-14-9-7-13(8-10-14)18(23)21-15-5-3-4-6-16(15)24-2/h3-10,19H,11H2,1-2H3,(H,21,23)
InChIKeyIZIDAWNMMHHOFB-UHFFFAOYSA-N
XLogP3.25
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.37
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 16591774
N-(2-methoxyphenyl)-4-(pyrimidin-5-ylmethylamino)benzamide
CID 119050113
4-[[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methylamino]-N-(2-methoxyphenyl)benzamide
CID 86919033
N-(2,5-dimethoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 51309899
4-[(4-fluorobenzoyl)amino]-N-(2-methoxyphenyl)benzamide
CID 2677066
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide
CID 9270594
N-[(2-methoxyphenyl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)acetamide
CID 110410122
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-4-phenylbenzamide
CID 26522657
4-methyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]aniline
CID 103746517
4-[[2-(1,2-benzoxazol-3-yl)acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 9270620
4-[[(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl]amino]-N-(2-methoxyphenyl)benzamide
CID 30798118
2-(difluoromethoxy)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]aniline
CID 103741993

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide?
The IUPAC name of N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide (CID 71922397) is N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide.
What is the SMILES notation for N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide?
The canonical SMILES for N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide is COc1ccccc1NC(=O)c1ccc(NCc2noc(C)n2)cc1.
What is the InChIKey of N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide?
The InChIKey is IZIDAWNMMHHOFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3/c1-12-20-17(22-25-12)11-19-14-9-7-13(8-10-14)18(23)21-15-5-3-4-6-16(15)24-2/h3-10,19H,11H2,1-2H3,(H,21,23).
What are the key properties of N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide?
N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide has a molecular weight of 338.37 g/mol, XLogP of 3.25, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methylamino]benzamide is sourced from PubChem (CID 71922397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).