N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine

C9H16N2S — CID 43533631

IUPACN-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC(NC1=NCCCS1)C1CC1
InChIInChI=1S/C9H16N2S/c1-7(8-3-4-8)11-9-10-5-2-6-12-9/h7-8H,2-6H2,1H3,(H,10,11)
InChIKeyGLTSTGLBIOZELL-UHFFFAOYSA-N
MW184.31 g/mol
LogP1.87
Rot. Bonds2

About N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine

N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 43533631) has the molecular formula C9H16N2S and a molecular weight of 184.31 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID43533631
Molecular FormulaC9H16N2S
Molecular Weight184.31 g/mol
Exact Mass184.10
IUPAC NameN-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC(NC1=NCCCS1)C1CC1
InChIInChI=1S/C9H16N2S/c1-7(8-3-4-8)11-9-10-5-2-6-12-9/h7-8H,2-6H2,1H3,(H,10,11)
InChIKeyGLTSTGLBIOZELL-UHFFFAOYSA-N
XLogP1.87
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.31
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-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 N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 43533631) is N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine is CC(NC1=NCCCS1)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is GLTSTGLBIOZELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2S/c1-7(8-3-4-8)11-9-10-5-2-6-12-9/h7-8H,2-6H2,1H3,(H,10,11).
What are the key properties of N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 184.31 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 43533631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).