N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine

C10H16N4S — CID 106049363

IUPACN-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCc1c(CNC2=NCCCS2)cnn1C
InChIInChI=1S/C10H16N4S/c1-8-9(7-13-14(8)2)6-12-10-11-4-3-5-15-10/h7H,3-6H2,1-2H3,(H,11,12)
InChIKeyNHINSEBWGYIEMG-UHFFFAOYSA-N
MW224.33 g/mol
LogP1.31
Rot. Bonds2

About N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine

N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 106049363) has the molecular formula C10H16N4S and a molecular weight of 224.33 g/mol. Its IUPAC name is N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID106049363
Molecular FormulaC10H16N4S
Molecular Weight224.33 g/mol
Exact Mass224.11
IUPAC NameN-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCc1c(CNC2=NCCCS2)cnn1C
InChIInChI=1S/C10H16N4S/c1-8-9(7-13-14(8)2)6-12-10-11-4-3-5-15-10/h7H,3-6H2,1-2H3,(H,11,12)
InChIKeyNHINSEBWGYIEMG-UHFFFAOYSA-N
XLogP1.31
TPSA42.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 106049363) is N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine is Cc1c(CNC2=NCCCS2)cnn1C.
What is the InChIKey of N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is NHINSEBWGYIEMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4S/c1-8-9(7-13-14(8)2)6-12-10-11-4-3-5-15-10/h7H,3-6H2,1-2H3,(H,11,12).
What are the key properties of N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 224.33 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,5-dimethylpyrazol-4-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 106049363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).