N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide

C13H14N4O3 — CID 119762149

IUPACN-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide
SMILESO=C(Nc1ccc(-c2ncon2)cc1)C1CNCCO1
InChIInChI=1S/C13H14N4O3/c18-13(11-7-14-5-6-19-11)16-10-3-1-9(2-4-10)12-15-8-20-17-12/h1-4,8,11,14H,5-7H2,(H,16,18)
InChIKeyXLTMCNKEGRCVJM-UHFFFAOYSA-N
MW274.28 g/mol
LogP0.66
Rot. Bonds3

About N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide

N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide (PubChem CID 119762149) has the molecular formula C13H14N4O3 and a molecular weight of 274.28 g/mol. Its IUPAC name is N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide
PubChem CID119762149
Molecular FormulaC13H14N4O3
Molecular Weight274.28 g/mol
Exact Mass274.11
IUPAC NameN-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide
SMILESO=C(Nc1ccc(-c2ncon2)cc1)C1CNCCO1
InChIInChI=1S/C13H14N4O3/c18-13(11-7-14-5-6-19-11)16-10-3-1-9(2-4-10)12-15-8-20-17-12/h1-4,8,11,14H,5-7H2,(H,16,18)
InChIKeyXLTMCNKEGRCVJM-UHFFFAOYSA-N
XLogP0.66
TPSA89.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-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-methylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119670966
N-[4-(cyclopropanecarbonylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119700164
N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119762118
N-(6-bromo-3-pyridinyl)morpholine-2-carboxamide
CID 103813958
N-(6-fluoro-3-pyridinyl)morpholine-2-carboxamide
CID 103808720
N-[4-(morpholine-4-carbonyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119712395
N-quinoxalin-6-ylmorpholine-2-carboxamide;hydrochloride
CID 119708415
N-(1,3-benzothiazol-5-yl)morpholine-2-carboxamide
CID 119735663
N-(1,2-oxazol-3-yl)morpholine-2-carboxamide
CID 62903772
3-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 115340051
N-[4-(oxolan-2-ylmethoxy)phenyl]morpholine-2-carboxamide
CID 119712753
2-methyl-2-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 80549799

Frequently Asked Questions

What is the IUPAC name of N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide?
The IUPAC name of N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide (CID 119762149) is N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide.
What is the SMILES notation for N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide?
The canonical SMILES for N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide is O=C(Nc1ccc(-c2ncon2)cc1)C1CNCCO1.
What is the InChIKey of N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide?
The InChIKey is XLTMCNKEGRCVJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O3/c18-13(11-7-14-5-6-19-11)16-10-3-1-9(2-4-10)12-15-8-20-17-12/h1-4,8,11,14H,5-7H2,(H,16,18).
What are the key properties of N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide?
N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide has a molecular weight of 274.28 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1,2,4-oxadiazol-3-yl)phenyl]morpholine-2-carboxamide is sourced from PubChem (CID 119762149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).