5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine

C16H15N3O2S — CID 67437967

IUPAC5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine
SMILESCOCC1SC(N)=NC12c1ccccc1Oc1cnccc12
InChIInChI=1S/C16H15N3O2S/c1-20-9-14-16(19-15(17)22-14)10-4-2-3-5-12(10)21-13-8-18-7-6-11(13)16/h2-8,14H,9H2,1H3,(H2,17,19)
InChIKeyRGRRGOOXNFSPMC-UHFFFAOYSA-N
MW313.38 g/mol
LogP2.51
Rot. Bonds2

About 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine

5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine (PubChem CID 67437967) has the molecular formula C16H15N3O2S and a molecular weight of 313.38 g/mol. Its IUPAC name is 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine.

Molecular Properties

Compound Name5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine
PubChem CID67437967
Molecular FormulaC16H15N3O2S
Molecular Weight313.38 g/mol
Exact Mass313.09
IUPAC Name5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine
SMILESCOCC1SC(N)=NC12c1ccccc1Oc1cnccc12
InChIInChI=1S/C16H15N3O2S/c1-20-9-14-16(19-15(17)22-14)10-4-2-3-5-12(10)21-13-8-18-7-6-11(13)16/h2-8,14H,9H2,1H3,(H2,17,19)
InChIKeyRGRRGOOXNFSPMC-UHFFFAOYSA-N
XLogP2.51
TPSA69.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.38
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine?
The IUPAC name of 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine (CID 67437967) is 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine.
What is the SMILES notation for 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine?
The canonical SMILES for 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine is COCC1SC(N)=NC12c1ccccc1Oc1cnccc12.
What is the InChIKey of 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine?
The InChIKey is RGRRGOOXNFSPMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2S/c1-20-9-14-16(19-15(17)22-14)10-4-2-3-5-12(10)21-13-8-18-7-6-11(13)16/h2-8,14H,9H2,1H3,(H2,17,19).
What are the key properties of 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine?
5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine has a molecular weight of 313.38 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)spiro[5H-1,3-thiazole-4,5'-chromeno[2,3-c]pyridine]-2-amine is sourced from PubChem (CID 67437967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).