2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide

C19H23N3O2 — CID 5176278

IUPAC2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide
SMILESO=C(NC1CCCc2ccccc21)c1coc(C2CCNCC2)n1
InChIInChI=1S/C19H23N3O2/c23-18(17-12-24-19(22-17)14-8-10-20-11-9-14)21-16-7-3-5-13-4-1-2-6-15(13)16/h1-2,4,6,12,14,16,20H,3,5,7-11H2,(H,21,23)
InChIKeyNTDCYIFVJUZSKB-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.95
Rot. Bonds3

About 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide

2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide (PubChem CID 5176278) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide
PubChem CID5176278
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide
SMILESO=C(NC1CCCc2ccccc21)c1coc(C2CCNCC2)n1
InChIInChI=1S/C19H23N3O2/c23-18(17-12-24-19(22-17)14-8-10-20-11-9-14)21-16-7-3-5-13-4-1-2-6-15(13)16/h1-2,4,6,12,14,16,20H,3,5,7-11H2,(H,21,23)
InChIKeyNTDCYIFVJUZSKB-UHFFFAOYSA-N
XLogP2.95
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide?
The IUPAC name of 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide (CID 5176278) is 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide is O=C(NC1CCCc2ccccc21)c1coc(C2CCNCC2)n1.
What is the InChIKey of 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide?
The InChIKey is NTDCYIFVJUZSKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c23-18(17-12-24-19(22-17)14-8-10-20-11-9-14)21-16-7-3-5-13-4-1-2-6-15(13)16/h1-2,4,6,12,14,16,20H,3,5,7-11H2,(H,21,23).
What are the key properties of 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide?
2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide has a molecular weight of 325.41 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 5176278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).