5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide

C16H15N3O2 — CID 75538115

IUPAC5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide
SMILESCC(C)c1cc(C(=O)Nc2cccc3cccnc23)no1
InChIInChI=1S/C16H15N3O2/c1-10(2)14-9-13(19-21-14)16(20)18-12-7-3-5-11-6-4-8-17-15(11)12/h3-10H,1-2H3,(H,18,20)
InChIKeyADCQWCRVBMLOMA-UHFFFAOYSA-N
MW281.31 g/mol
LogP3.60
Rot. Bonds3

About 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide

5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide (PubChem CID 75538115) has the molecular formula C16H15N3O2 and a molecular weight of 281.31 g/mol. Its IUPAC name is 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide
PubChem CID75538115
Molecular FormulaC16H15N3O2
Molecular Weight281.31 g/mol
Exact Mass281.12
IUPAC Name5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide
SMILESCC(C)c1cc(C(=O)Nc2cccc3cccnc23)no1
InChIInChI=1S/C16H15N3O2/c1-10(2)14-9-13(19-21-14)16(20)18-12-7-3-5-11-6-4-8-17-15(11)12/h3-10H,1-2H3,(H,18,20)
InChIKeyADCQWCRVBMLOMA-UHFFFAOYSA-N
XLogP3.60
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-propan-2-yl-N-quinolin-8-yl-1H-pyrazole-3-carboxamide
CID 110863444
5-(2-methylpropylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109181365
6-methyl-2-(propan-2-ylamino)-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109319423
6-chloro-N-quinolin-8-ylpyridine-2-carboxamide
CID 62235243
2-N-(5-methyl-1,2-oxazol-3-yl)-4-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109093313
N-quinolin-8-ylpyrazine-2-carboxamide
CID 139088852
5-(methylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 104639694
N-(2,6-dimethylphenyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 3076174
6-N-(2,4-dimethylphenyl)-2-N-quinolin-8-ylpyridine-2,6-dicarboxamide
CID 109100392
4-(3-methylbutylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109217470
5-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103817057
6-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103186933

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide (CID 75538115) is 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide is CC(C)c1cc(C(=O)Nc2cccc3cccnc23)no1.
What is the InChIKey of 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide?
The InChIKey is ADCQWCRVBMLOMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-10(2)14-9-13(19-21-14)16(20)18-12-7-3-5-11-6-4-8-17-15(11)12/h3-10H,1-2H3,(H,18,20).
What are the key properties of 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide?
5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-N-quinolin-8-yl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 75538115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).