N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide

C19H17N3O2 — CID 2461257

IUPACN-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCCn1c2ccccc2c2cc(NC(=O)c3cc(C)on3)ccc21
InChIInChI=1S/C19H17N3O2/c1-3-22-17-7-5-4-6-14(17)15-11-13(8-9-18(15)22)20-19(23)16-10-12(2)24-21-16/h4-11H,3H2,1-2H3,(H,20,23)
InChIKeyIHLJGRKMODLXFG-UHFFFAOYSA-N
MW319.36 g/mol
LogP4.36
Rot. Bonds3

About N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide

N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide (PubChem CID 2461257) has the molecular formula C19H17N3O2 and a molecular weight of 319.36 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide
PubChem CID2461257
Molecular FormulaC19H17N3O2
Molecular Weight319.36 g/mol
Exact Mass319.13
IUPAC NameN-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide
SMILESCCn1c2ccccc2c2cc(NC(=O)c3cc(C)on3)ccc21
InChIInChI=1S/C19H17N3O2/c1-3-22-17-7-5-4-6-14(17)15-11-13(8-9-18(15)22)20-19(23)16-10-12(2)24-21-16/h4-11H,3H2,1-2H3,(H,20,23)
InChIKeyIHLJGRKMODLXFG-UHFFFAOYSA-N
XLogP4.36
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide (CID 2461257) is N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide is CCn1c2ccccc2c2cc(NC(=O)c3cc(C)on3)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide?
The InChIKey is IHLJGRKMODLXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2/c1-3-22-17-7-5-4-6-14(17)15-11-13(8-9-18(15)22)20-19(23)16-10-12(2)24-21-16/h4-11H,3H2,1-2H3,(H,20,23).
What are the key properties of N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide?
N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide has a molecular weight of 319.36 g/mol, XLogP of 4.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-5-methyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 2461257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).