N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine

C8H12N8OS — CID 80887079

IUPACN-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine
SMILESCCNc1nc(OC)nc(Sc2nnnn2C)n1
InChIInChI=1S/C8H12N8OS/c1-4-9-5-10-6(17-3)12-7(11-5)18-8-13-14-15-16(8)2/h4H2,1-3H3,(H,9,10,11,12)
InChIKeyWSMSYKVZFSAFSK-UHFFFAOYSA-N
MW268.31 g/mol
LogP-0.01
Rot. Bonds5

About N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine

N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine (PubChem CID 80887079) has the molecular formula C8H12N8OS and a molecular weight of 268.31 g/mol. Its IUPAC name is N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine
PubChem CID80887079
Molecular FormulaC8H12N8OS
Molecular Weight268.31 g/mol
Exact Mass268.09
IUPAC NameN-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine
SMILESCCNc1nc(OC)nc(Sc2nnnn2C)n1
InChIInChI=1S/C8H12N8OS/c1-4-9-5-10-6(17-3)12-7(11-5)18-8-13-14-15-16(8)2/h4H2,1-3H3,(H,9,10,11,12)
InChIKeyWSMSYKVZFSAFSK-UHFFFAOYSA-N
XLogP-0.01
TPSA103.53 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Analyze N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-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

Related Compounds

4-chloro-N-ethyl-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine
CID 80888245
2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]sulfanyl]pyrimidine-4,6-diamine
CID 80885688
N-ethyl-4-methoxy-6-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine
CID 80892730
N-ethyl-4-(1-methyltetrazol-5-yl)sulfanylquinazolin-2-amine
CID 80887083
4-(3,4-dimethylphenyl)sulfanyl-N-ethyl-6-methoxy-1,3,5-triazin-2-amine
CID 80893106
N-ethyl-4-methoxy-6-thiophen-2-ylsulfanyl-1,3,5-triazin-2-amine
CID 80888545
N-ethyl-4-methoxy-6-(4-propan-2-ylphenyl)sulfanyl-1,3,5-triazin-2-amine
CID 80872033
4-(1-methyltetrazol-5-yl)sulfanyl-6-propoxy-1,3,5-triazin-2-amine
CID 80887985
N-ethyl-4-methoxy-6-(1,3-thiazol-2-ylsulfanyl)-1,3,5-triazin-2-amine
CID 80885392
4-chloro-6-methoxy-2-(1-methyltetrazol-5-yl)sulfanylpyrimidine
CID 89206264
4-(2,4-difluorophenyl)sulfanyl-N-ethyl-6-methoxy-1,3,5-triazin-2-amine
CID 80893899
N-ethyl-6-(1-methyltetrazol-5-yl)sulfanylpyrazin-2-amine
CID 78990345

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine?
The IUPAC name of N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine (CID 80887079) is N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine?
The canonical SMILES for N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine is CCNc1nc(OC)nc(Sc2nnnn2C)n1.
What is the InChIKey of N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine?
The InChIKey is WSMSYKVZFSAFSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N8OS/c1-4-9-5-10-6(17-3)12-7(11-5)18-8-13-14-15-16(8)2/h4H2,1-3H3,(H,9,10,11,12).
What are the key properties of N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine?
N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine has a molecular weight of 268.31 g/mol, XLogP of -0.01, 5 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methoxy-6-(1-methyltetrazol-5-yl)sulfanyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80887079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).