N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide

C13H10N4O2 — CID 81257187

IUPACN-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide
SMILESO=C(Nc1cccc(-c2cnco2)c1)n1ccnc1
InChIInChI=1S/C13H10N4O2/c18-13(17-5-4-14-8-17)16-11-3-1-2-10(6-11)12-7-15-9-19-12/h1-9H,(H,16,18)
InChIKeyLJJRTUFYGOYPMK-UHFFFAOYSA-N
MW254.25 g/mol
LogP2.62
Rot. Bonds2

About N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide

N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide (PubChem CID 81257187) has the molecular formula C13H10N4O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide.

Molecular Properties

Compound NameN-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide
PubChem CID81257187
Molecular FormulaC13H10N4O2
Molecular Weight254.25 g/mol
Exact Mass254.08
IUPAC NameN-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide
SMILESO=C(Nc1cccc(-c2cnco2)c1)n1ccnc1
InChIInChI=1S/C13H10N4O2/c18-13(17-5-4-14-8-17)16-11-3-1-2-10(6-11)12-7-15-9-19-12/h1-9H,(H,16,18)
InChIKeyLJJRTUFYGOYPMK-UHFFFAOYSA-N
XLogP2.62
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 47265687
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754
N-(3-acetylphenyl)imidazole-1-carboxamide
CID 81258078
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]but-2-enamide
CID 47353684
3-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]benzamide
CID 47051399
5-[3-(1,3-oxazol-5-yl)anilino]-5-oxopentanoic acid
CID 60934205
2-chloro-N-[3-(1,3-oxazol-5-yl)phenyl]pyridine-3-carboxamide
CID 61041502
(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide
CID 61180352
2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
CID 76888066
3-amino-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
CID 54862859
4-amino-1-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pyrrole-2-carboxamide
CID 61102969
N-[3-[(2-methoxyacetyl)amino]phenyl]imidazole-1-carboxamide
CID 81257160

Frequently Asked Questions

What is the IUPAC name of N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide?
The IUPAC name of N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide (CID 81257187) is N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide.
What is the SMILES notation for N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide?
The canonical SMILES for N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide is O=C(Nc1cccc(-c2cnco2)c1)n1ccnc1.
What is the InChIKey of N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide?
The InChIKey is LJJRTUFYGOYPMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O2/c18-13(17-5-4-14-8-17)16-11-3-1-2-10(6-11)12-7-15-9-19-12/h1-9H,(H,16,18).
What are the key properties of N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide?
N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide has a molecular weight of 254.25 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1,3-oxazol-5-yl)phenyl]imidazole-1-carboxamide is sourced from PubChem (CID 81257187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).