N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide

C15H18N4O3 — CID 120835397

IUPACN-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide
SMILESCc1ccc(NC(=O)Cc2noc([C@H]3CNCCO3)n2)cc1
InChIInChI=1S/C15H18N4O3/c1-10-2-4-11(5-3-10)17-14(20)8-13-18-15(22-19-13)12-9-16-6-7-21-12/h2-5,12,16H,6-9H2,1H3,(H,17,20)/t12-/m1/s1
InChIKeyVSMOJBRSOQVYHC-GFCCVEGCSA-N
MW302.33 g/mol
LogP1.22
Rot. Bonds4

About N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide

N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide (PubChem CID 120835397) has the molecular formula C15H18N4O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide
PubChem CID120835397
Molecular FormulaC15H18N4O3
Molecular Weight302.33 g/mol
Exact Mass302.14
IUPAC NameN-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide
SMILESCc1ccc(NC(=O)Cc2noc([C@H]3CNCCO3)n2)cc1
InChIInChI=1S/C15H18N4O3/c1-10-2-4-11(5-3-10)17-14(20)8-13-18-15(22-19-13)12-9-16-6-7-21-12/h2-5,12,16H,6-9H2,1H3,(H,17,20)/t12-/m1/s1
InChIKeyVSMOJBRSOQVYHC-GFCCVEGCSA-N
XLogP1.22
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclohexyl-2-[5-[(2S)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide
CID 120835213
2-[5-(5-azaspiro[2.4]heptan-2-yl)-1,2,4-oxadiazol-3-yl]-N-(4-methylphenyl)acetamide;hydrochloride
CID 120835324
(2S)-2-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]morpholine
CID 120833777
(2R)-2-[3-(2-phenylethyl)-1,2,4-oxadiazol-5-yl]morpholine
CID 120834209
2-[5-[(3aS,6aS)-2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-3a-yl]-1,2,4-oxadiazol-3-yl]-N-(4-methylphenyl)acetamide
CID 120835352
2-[5-[4-(aminomethyl)oxan-4-yl]-1,2,4-oxadiazol-3-yl]-N-(4-methylphenyl)acetamide;hydrochloride
CID 120955587
N-phenyl-2-[5-[(2R,3S)-2-propan-2-yloxolan-3-yl]-1,2,4-oxadiazol-3-yl]acetamide
CID 124843527
N-(4-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
4-methyl-N-(6-morpholin-2-yl-3-pyridinyl)benzamide
CID 123703173
4-methyl-N-[6-[(2R)-morpholin-2-yl]-3-pyridinyl]benzamide
CID 144953548
(2S)-2-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]morpholine;hydrochloride
CID 120836385
4-(5-morpholin-2-yl-1,2,4-oxadiazol-3-yl)phenol
CID 135991810

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide?
The IUPAC name of N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide (CID 120835397) is N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide.
What is the SMILES notation for N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide?
The canonical SMILES for N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide is Cc1ccc(NC(=O)Cc2noc([C@H]3CNCCO3)n2)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide?
The InChIKey is VSMOJBRSOQVYHC-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H18N4O3/c1-10-2-4-11(5-3-10)17-14(20)8-13-18-15(22-19-13)12-9-16-6-7-21-12/h2-5,12,16H,6-9H2,1H3,(H,17,20)/t12-/m1/s1.
What are the key properties of N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide?
N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide has a molecular weight of 302.33 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-[5-[(2R)-morpholin-2-yl]-1,2,4-oxadiazol-3-yl]acetamide is sourced from PubChem (CID 120835397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).