N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide

C23H19N3O4 — CID 167752994

IUPACN-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide
SMILESCOc1ccccc1OCc1ccccc1NC(=O)c1cccc(-c2ncon2)c1
InChIInChI=1S/C23H19N3O4/c1-28-20-11-4-5-12-21(20)29-14-18-7-2-3-10-19(18)25-23(27)17-9-6-8-16(13-17)22-24-15-30-26-22/h2-13,15H,14H2,1H3,(H,25,27)
InChIKeyCWUFFWCONFILMI-UHFFFAOYSA-N
MW401.42 g/mol
LogP4.58
Rot. Bonds7

About N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide

N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide (PubChem CID 167752994) has the molecular formula C23H19N3O4 and a molecular weight of 401.42 g/mol. Its IUPAC name is N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide.

Molecular Properties

Compound NameN-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide
PubChem CID167752994
Molecular FormulaC23H19N3O4
Molecular Weight401.42 g/mol
Exact Mass401.14
IUPAC NameN-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide
SMILESCOc1ccccc1OCc1ccccc1NC(=O)c1cccc(-c2ncon2)c1
InChIInChI=1S/C23H19N3O4/c1-28-20-11-4-5-12-21(20)29-14-18-7-2-3-10-19(18)25-23(27)17-9-6-8-16(13-17)22-24-15-30-26-22/h2-13,15H,14H2,1H3,(H,25,27)
InChIKeyCWUFFWCONFILMI-UHFFFAOYSA-N
XLogP4.58
TPSA86.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.42
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-[(2-amino-3-pyridinyl)oxymethyl]phenyl]-3,4,5-trimethoxybenzamide
CID 143408158
N-(2-methoxyphenyl)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)benzamide
CID 50828728
N-[[2-[(3,4-dimethoxybenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108925835
N-(2-ethylphenyl)-3-methoxy-4-methylbenzamide
CID 16620352
N-(2-acetylphenyl)-3,4-dimethoxybenzamide
CID 17394178
N-(1,3-benzodioxol-4-yl)-3-methoxy-4-phenylmethoxybenzamide
CID 75453681
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[2-(methoxymethyl)phenyl]benzamide
CID 55714868
3,4-diethoxy-N-(2-methoxyphenyl)benzamide
CID 669527
N-(2-bromophenyl)-3-methoxy-4-phenylmethoxybenzamide
CID 1288452
3-methoxy-4-[(2-methylphenyl)methoxy]-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 145489208
N-(2-benzylphenyl)-3-methoxy-4-propoxybenzamide
CID 2461218
3-(3-methoxyphenyl)-1,2,4-oxadiazole
CID 57176807

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide?
The IUPAC name of N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide (CID 167752994) is N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide.
What is the SMILES notation for N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide?
The canonical SMILES for N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide is COc1ccccc1OCc1ccccc1NC(=O)c1cccc(-c2ncon2)c1.
What is the InChIKey of N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide?
The InChIKey is CWUFFWCONFILMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O4/c1-28-20-11-4-5-12-21(20)29-14-18-7-2-3-10-19(18)25-23(27)17-9-6-8-16(13-17)22-24-15-30-26-22/h2-13,15H,14H2,1H3,(H,25,27).
What are the key properties of N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide?
N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide has a molecular weight of 401.42 g/mol, XLogP of 4.58, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2-methoxyphenoxy)methyl]phenyl]-3-(1,2,4-oxadiazol-3-yl)benzamide is sourced from PubChem (CID 167752994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).