1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole

C20H20N6OS — CID 174511025

IUPAC1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole
SMILESNc1ccc2ccccc2n1.Nc1ccccn1.c1cocn1.c1cscn1
InChIInChI=1S/C9H8N2.C5H6N2.C3H3NO.C3H3NS/c10-9-6-5-7-3-1-2-4-8(7)11-9;6-5-3-1-2-4-7-5;2*1-2-5-3-4-1/h1-6H,(H2,10,11);1-4H,(H2,6,7);2*1-3H
InChIKeyHIOZIPGOVVBNDA-UHFFFAOYSA-N
MW392.49 g/mol
LogP4.30
Rot. Bonds

About 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole

1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole (PubChem CID 174511025) has the molecular formula C20H20N6OS and a molecular weight of 392.49 g/mol. Its IUPAC name is 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole.

Molecular Properties

Compound Name1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole
PubChem CID174511025
Molecular FormulaC20H20N6OS
Molecular Weight392.49 g/mol
Exact Mass392.14
IUPAC Name1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole
SMILESNc1ccc2ccccc2n1.Nc1ccccn1.c1cocn1.c1cscn1
InChIInChI=1S/C9H8N2.C5H6N2.C3H3NO.C3H3NS/c10-9-6-5-7-3-1-2-4-8(7)11-9;6-5-3-1-2-4-7-5;2*1-2-5-3-4-1/h1-6H,(H2,10,11);1-4H,(H2,6,7);2*1-3H
InChIKeyHIOZIPGOVVBNDA-UHFFFAOYSA-N
XLogP4.30
TPSA116.74 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.49
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Launch Full Analysis

Related Compounds

1-[5-[(5-Ethyl-1,3-oxazol-2-yl)methylsulfanyl]-1,3-thiazol-2-yl]-3-quinolin-6-ylurea
CID 22970858
2-[2-Pyrimidin-2-yl-4-quinolin-2-yl-5-(1,3-thiazol-2-yl)imidazol-1-yl]-1,3-oxazole
CID 141180705
5-N-(1H-imidazol-2-yl)-4-N-(1,3-oxazol-2-yl)-2-N-pyrimidin-2-yl-3-N-(1,3-thiazol-2-yl)quinoline-2,3,4,5-tetramine
CID 148548203
4-N-(1,3-oxazol-2-yl)-2-N-pyrimidin-2-yl-3-N-(1,3-thiazol-2-yl)quinoline-2,3,4-triamine
CID 149252158
benzene;ethane;2H-imidazo[1,2-a]pyridin-4-ium;1,2,4-oxadiazole;1,3-oxazole;pyridine;pyrimidine;quinoline;1,3-thiazole
CID 157210642
1,3-Oxazole;quinoline;1,3-thiazole
CID 158077050
1,3-Oxazole;quinolin-2-amine
CID 159388854
1H-indole;morpholine;1,3-oxazole;pyrazine;1,3-thiazole
CID 172713361
1H-indole;1,3-oxazole;pyrazine;1,3-thiazole
CID 172746684
1,8-Naphthyridin-2-amine;1,3-oxazole;pyridin-2-amine;1,3-thiazole
CID 174511237
2-(1,3-Oxazol-2-ylsulfanyl)quinoline-4-carboximidamide
CID 106922776
N-ethyl-3-(1,3-oxazol-2-ylsulfanylmethyl)quinolin-2-amine
CID 106925507

Frequently Asked Questions

What is the IUPAC name of 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole?
The IUPAC name of 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole (CID 174511025) is 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole.
What is the SMILES notation for 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole?
The canonical SMILES for 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole is Nc1ccc2ccccc2n1.Nc1ccccn1.c1cocn1.c1cscn1.
What is the InChIKey of 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole?
The InChIKey is HIOZIPGOVVBNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2.C5H6N2.C3H3NO.C3H3NS/c10-9-6-5-7-3-1-2-4-8(7)11-9;6-5-3-1-2-4-7-5;2*1-2-5-3-4-1/h1-6H,(H2,10,11);1-4H,(H2,6,7);2*1-3H.
What are the key properties of 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole?
1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole has a molecular weight of 392.49 g/mol, XLogP of 4.30, 0 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-oxazole;pyridin-2-amine;quinolin-2-amine;1,3-thiazole is sourced from PubChem (CID 174511025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).