N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide

C19H16N4O2 — CID 51105757

IUPACN-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide
SMILESO=C(NCCc1coc(-c2ccccc2)n1)c1n[nH]c2ccccc12
InChIInChI=1S/C19H16N4O2/c24-18(17-15-8-4-5-9-16(15)22-23-17)20-11-10-14-12-25-19(21-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,20,24)(H,22,23)
InChIKeyQHFAAPVLNZYBGN-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.19
Rot. Bonds5

About N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide

N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide (PubChem CID 51105757) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide
PubChem CID51105757
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC NameN-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide
SMILESO=C(NCCc1coc(-c2ccccc2)n1)c1n[nH]c2ccccc12
InChIInChI=1S/C19H16N4O2/c24-18(17-15-8-4-5-9-16(15)22-23-17)20-11-10-14-12-25-19(21-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,20,24)(H,22,23)
InChIKeyQHFAAPVLNZYBGN-UHFFFAOYSA-N
XLogP3.19
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide?
The IUPAC name of N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide (CID 51105757) is N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide.
What is the SMILES notation for N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide?
The canonical SMILES for N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide is O=C(NCCc1coc(-c2ccccc2)n1)c1n[nH]c2ccccc12.
What is the InChIKey of N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide?
The InChIKey is QHFAAPVLNZYBGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c24-18(17-15-8-4-5-9-16(15)22-23-17)20-11-10-14-12-25-19(21-14)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,20,24)(H,22,23).
What are the key properties of N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide?
N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 3.19, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-phenyl-1,3-oxazol-4-yl)ethyl]-1H-indazole-3-carboxamide is sourced from PubChem (CID 51105757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).