4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine

C10H15ClN4S — CID 80889137

IUPAC4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine
SMILESCC1CCCC(Sc2nc(N)nc(Cl)n2)C1
InChIInChI=1S/C10H15ClN4S/c1-6-3-2-4-7(5-6)16-10-14-8(11)13-9(12)15-10/h6-7H,2-5H2,1H3,(H2,12,13,14,15)
InChIKeyGFLYPCJYHWPGRC-UHFFFAOYSA-N
MW258.78 g/mol
LogP2.78
Rot. Bonds2

About 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine

4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine (PubChem CID 80889137) has the molecular formula C10H15ClN4S and a molecular weight of 258.78 g/mol. Its IUPAC name is 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine
PubChem CID80889137
Molecular FormulaC10H15ClN4S
Molecular Weight258.78 g/mol
Exact Mass258.07
IUPAC Name4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine
SMILESCC1CCCC(Sc2nc(N)nc(Cl)n2)C1
InChIInChI=1S/C10H15ClN4S/c1-6-3-2-4-7(5-6)16-10-14-8(11)13-9(12)15-10/h6-7H,2-5H2,1H3,(H2,12,13,14,15)
InChIKeyGFLYPCJYHWPGRC-UHFFFAOYSA-N
XLogP2.78
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.78
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-chloro-6-(3-methylcyclohexyl)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

2,4-Dichloro-6-(2-ethylhexylsulfanyl)-1,3,5-triazine
CID 175575169
2-Chloro-4-methoxy-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazine
CID 55124271
4-chloro-N,N-dimethyl-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine
CID 55125428
2,4-Dichloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazine
CID 62868572
4-Chloro-6-cyclohexylsulfanyl-1,3,5-triazin-2-amine
CID 80886394
4-Chloro-6-(cyclopentylmethylsulfanyl)-1,3,5-triazin-2-amine
CID 80888749
2-N,2-N-dimethyl-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazine-2,4-diamine
CID 80888968
4-chloro-N-ethyl-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine
CID 80889227
4-Methoxy-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine
CID 80889318
4-chloro-6-(cyclopentylmethylsulfanyl)-N-methyl-1,3,5-triazin-2-amine
CID 80889605
4-(3-Methylcyclohexyl)sulfanyl-6-propoxy-1,3,5-triazin-2-amine
CID 80889650
2-N,2-N,4-N-trimethyl-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazine-2,4-diamine
CID 80889651

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine (CID 80889137) is 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine is CC1CCCC(Sc2nc(N)nc(Cl)n2)C1.
What is the InChIKey of 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine?
The InChIKey is GFLYPCJYHWPGRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4S/c1-6-3-2-4-7(5-6)16-10-14-8(11)13-9(12)15-10/h6-7H,2-5H2,1H3,(H2,12,13,14,15).
What are the key properties of 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine?
4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine has a molecular weight of 258.78 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(3-methylcyclohexyl)sulfanyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80889137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).