5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide

C17H15N3O3 — CID 126668723

IUPAC5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide
SMILESO=C(NC1CCc2ccccc2C1)c1cnc2occn2c1=O
InChIInChI=1S/C17H15N3O3/c21-15(14-10-18-17-20(16(14)22)7-8-23-17)19-13-6-5-11-3-1-2-4-12(11)9-13/h1-4,7-8,10,13H,5-6,9H2,(H,19,21)
InChIKeyNVIBBZJDSMCQCX-UHFFFAOYSA-N
MW309.33 g/mol
LogP1.57
Rot. Bonds2

About 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide

5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 126668723) has the molecular formula C17H15N3O3 and a molecular weight of 309.33 g/mol. Its IUPAC name is 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide
PubChem CID126668723
Molecular FormulaC17H15N3O3
Molecular Weight309.33 g/mol
Exact Mass309.11
IUPAC Name5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide
SMILESO=C(NC1CCc2ccccc2C1)c1cnc2occn2c1=O
InChIInChI=1S/C17H15N3O3/c21-15(14-10-18-17-20(16(14)22)7-8-23-17)19-13-6-5-11-3-1-2-4-12(11)9-13/h1-4,7-8,10,13H,5-6,9H2,(H,19,21)
InChIKeyNVIBBZJDSMCQCX-UHFFFAOYSA-N
XLogP1.57
TPSA76.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-7-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
CID 90650543
2-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridine-3-carboxamide
CID 10199216
2-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
CID 60630141
N-cyclohexyl-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 16620977
6-chloro-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide
CID 22318688
5-bromo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-2-carboxamide
CID 62953418
6-methyl-4-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1H-pyridine-3-carboxamide
CID 103717380
2-chloro-6-methyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridine-3-carboxamide
CID 20872301
N-(1,2,3,4-tetrahydronaphthalen-2-yl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide
CID 102555552
2-chloro-5-hydroxy-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzamide
CID 106501740
N-[(6S)-3-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 95154221
4-methyl-2-oxo-1-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyridine-3-carboxamide
CID 172672451

Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide?
The IUPAC name of 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide (CID 126668723) is 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide is O=C(NC1CCc2ccccc2C1)c1cnc2occn2c1=O.
What is the InChIKey of 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide?
The InChIKey is NVIBBZJDSMCQCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O3/c21-15(14-10-18-17-20(16(14)22)7-8-23-17)19-13-6-5-11-3-1-2-4-12(11)9-13/h1-4,7-8,10,13H,5-6,9H2,(H,19,21).
What are the key properties of 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide?
5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 309.33 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(1,2,3,4-tetrahydronaphthalen-2-yl)-[1,3]oxazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 126668723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).