5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide

C19H18N4O2 — CID 91305047

IUPAC5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide
SMILESNc1onc(-c2ccccn2)c1C(=O)Nc1cccc2c1CCCC2
InChIInChI=1S/C19H18N4O2/c20-18-16(17(23-25-18)15-9-3-4-11-21-15)19(24)22-14-10-5-7-12-6-1-2-8-13(12)14/h3-5,7,9-11H,1-2,6,8,20H2,(H,22,24)
InChIKeyPQNBGGCUBIFHFA-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.45
Rot. Bonds3

About 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide

5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide (PubChem CID 91305047) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide
PubChem CID91305047
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide
SMILESNc1onc(-c2ccccn2)c1C(=O)Nc1cccc2c1CCCC2
InChIInChI=1S/C19H18N4O2/c20-18-16(17(23-25-18)15-9-3-4-11-21-15)19(24)22-14-10-5-7-12-6-1-2-8-13(12)14/h3-5,7,9-11H,1-2,6,8,20H2,(H,22,24)
InChIKeyPQNBGGCUBIFHFA-UHFFFAOYSA-N
XLogP3.45
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide (CID 91305047) is 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide is Nc1onc(-c2ccccn2)c1C(=O)Nc1cccc2c1CCCC2.
What is the InChIKey of 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide?
The InChIKey is PQNBGGCUBIFHFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c20-18-16(17(23-25-18)15-9-3-4-11-21-15)19(24)22-14-10-5-7-12-6-1-2-8-13(12)14/h3-5,7,9-11H,1-2,6,8,20H2,(H,22,24).
What are the key properties of 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide?
5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-pyridin-2-yl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 91305047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).