1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole

C19H19N7OS — CID 174511237

IUPAC1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole
SMILESNc1ccc2cccnc2n1.Nc1ccccn1.c1cocn1.c1cscn1
InChIInChI=1S/C8H7N3.C5H6N2.C3H3NO.C3H3NS/c9-7-4-3-6-2-1-5-10-8(6)11-7;6-5-3-1-2-4-7-5;2*1-2-5-3-4-1/h1-5H,(H2,9,10,11);1-4H,(H2,6,7);2*1-3H
InChIKeyPGSCABYCRCWOIC-UHFFFAOYSA-N
MW393.48 g/mol
LogP3.69
Rot. Bonds

About 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole

1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole (PubChem CID 174511237) has the molecular formula C19H19N7OS and a molecular weight of 393.48 g/mol. Its IUPAC name is 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole.

Molecular Properties

Compound Name1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole
PubChem CID174511237
Molecular FormulaC19H19N7OS
Molecular Weight393.48 g/mol
Exact Mass393.14
IUPAC Name1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole
SMILESNc1ccc2cccnc2n1.Nc1ccccn1.c1cocn1.c1cscn1
InChIInChI=1S/C8H7N3.C5H6N2.C3H3NO.C3H3NS/c9-7-4-3-6-2-1-5-10-8(6)11-7;6-5-3-1-2-4-7-5;2*1-2-5-3-4-1/h1-5H,(H2,9,10,11);1-4H,(H2,6,7);2*1-3H
InChIKeyPGSCABYCRCWOIC-UHFFFAOYSA-N
XLogP3.69
TPSA129.63 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.48
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole?
The IUPAC name of 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole (CID 174511237) is 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole.
What is the SMILES notation for 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole?
The canonical SMILES for 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole is Nc1ccc2cccnc2n1.Nc1ccccn1.c1cocn1.c1cscn1.
What is the InChIKey of 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole?
The InChIKey is PGSCABYCRCWOIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3.C5H6N2.C3H3NO.C3H3NS/c9-7-4-3-6-2-1-5-10-8(6)11-7;6-5-3-1-2-4-7-5;2*1-2-5-3-4-1/h1-5H,(H2,9,10,11);1-4H,(H2,6,7);2*1-3H.
What are the key properties of 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole?
1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole has a molecular weight of 393.48 g/mol, XLogP of 3.69, 0 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole is sourced from PubChem (CID 174511237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).