4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide

C16H11IN2O2 — CID 60811320

IUPAC4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2cnco2)cc1)c1ccc(I)cc1
InChIInChI=1S/C16H11IN2O2/c17-13-5-1-12(2-6-13)16(20)19-14-7-3-11(4-8-14)15-9-18-10-21-15/h1-10H,(H,19,20)
InChIKeyAZMZEGVEWMAZGH-UHFFFAOYSA-N
MW390.18 g/mol
LogP4.20
Rot. Bonds3

About 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide

4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide (PubChem CID 60811320) has the molecular formula C16H11IN2O2 and a molecular weight of 390.18 g/mol. Its IUPAC name is 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
PubChem CID60811320
Molecular FormulaC16H11IN2O2
Molecular Weight390.18 g/mol
Exact Mass389.99
IUPAC Name4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
SMILESO=C(Nc1ccc(-c2cnco2)cc1)c1ccc(I)cc1
InChIInChI=1S/C16H11IN2O2/c17-13-5-1-12(2-6-13)16(20)19-14-7-3-11(4-8-14)15-9-18-10-21-15/h1-10H,(H,19,20)
InChIKeyAZMZEGVEWMAZGH-UHFFFAOYSA-N
XLogP4.20
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.18
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

3-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 60810765
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-(1,3-oxazol-5-yl)benzamide
CID 47049817
N-(6-methoxy-3-pyridinyl)-4-(1,3-oxazol-5-yl)benzamide
CID 51085481
4-iodo-N-[4-[(4-iodobenzoyl)amino]phenyl]benzamide
CID 4105689
N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 78890208
4-chloro-3-methylsulfonyl-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide
CID 87046723
4-(1,3-oxazol-5-yl)-N-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]benzamide
CID 55836609
2,2-dimethyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 2806322
N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]-4-(1,3-oxazol-5-yl)benzamide
CID 55819813
3-bromo-N-[4-(1,3-oxazol-5-yl)phenyl]thiophene-2-carboxamide
CID 61216626
4-amino-N-[4-(1,3-oxazol-5-yl)phenyl]-1,2,5-oxadiazole-3-carboxamide
CID 62688151
6-chloro-N-[4-(1,3-oxazol-5-yl)phenyl]pyridine-2-carboxamide
CID 62233090

Frequently Asked Questions

What is the IUPAC name of 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide?
The IUPAC name of 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide (CID 60811320) is 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide.
What is the SMILES notation for 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide?
The canonical SMILES for 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide is O=C(Nc1ccc(-c2cnco2)cc1)c1ccc(I)cc1.
What is the InChIKey of 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide?
The InChIKey is AZMZEGVEWMAZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11IN2O2/c17-13-5-1-12(2-6-13)16(20)19-14-7-3-11(4-8-14)15-9-18-10-21-15/h1-10H,(H,19,20).
What are the key properties of 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide?
4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide has a molecular weight of 390.18 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iodo-N-[4-(1,3-oxazol-5-yl)phenyl]benzamide is sourced from PubChem (CID 60811320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).