6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine

C14H20N4OS2 — CID 103326239

IUPAC6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCNc1nc(N2CCS(=O)CC2)c2cc(C)sc2n1
InChIInChI=1S/C14H20N4OS2/c1-3-4-15-14-16-12(18-5-7-21(19)8-6-18)11-9-10(2)20-13(11)17-14/h9H,3-8H2,1-2H3,(H,15,16,17)
InChIKeyKWEXVHARMSXMRG-UHFFFAOYSA-N
MW324.48 g/mol
LogP2.39
Rot. Bonds4

About 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine

6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103326239) has the molecular formula C14H20N4OS2 and a molecular weight of 324.48 g/mol. Its IUPAC name is 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103326239
Molecular FormulaC14H20N4OS2
Molecular Weight324.48 g/mol
Exact Mass324.11
IUPAC Name6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine
SMILESCCCNc1nc(N2CCS(=O)CC2)c2cc(C)sc2n1
InChIInChI=1S/C14H20N4OS2/c1-3-4-15-14-16-12(18-5-7-21(19)8-6-18)11-9-10(2)20-13(11)17-14/h9H,3-8H2,1-2H3,(H,15,16,17)
InChIKeyKWEXVHARMSXMRG-UHFFFAOYSA-N
XLogP2.39
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.48
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-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 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine (CID 103326239) is 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine is CCCNc1nc(N2CCS(=O)CC2)c2cc(C)sc2n1.
What is the InChIKey of 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is KWEXVHARMSXMRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS2/c1-3-4-15-14-16-12(18-5-7-21(19)8-6-18)11-9-10(2)20-13(11)17-14/h9H,3-8H2,1-2H3,(H,15,16,17).
What are the key properties of 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine?
6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 324.48 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(1-oxo-1,4-thiazinan-4-yl)-N-propylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103326239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).