2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine

C10H17N3S — CID 102767119

IUPAC2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine
SMILESCN(c1ncc(N)s1)C1CCCCC1
InChIInChI=1S/C10H17N3S/c1-13(8-5-3-2-4-6-8)10-12-7-9(11)14-10/h7-8H,2-6,11H2,1H3
InChIKeyQWUHLDLOHMRXPA-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.49
Rot. Bonds2

About 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine

2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine (PubChem CID 102767119) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine.

Molecular Properties

Compound Name2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine
PubChem CID102767119
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine
SMILESCN(c1ncc(N)s1)C1CCCCC1
InChIInChI=1S/C10H17N3S/c1-13(8-5-3-2-4-6-8)10-12-7-9(11)14-10/h7-8H,2-6,11H2,1H3
InChIKeyQWUHLDLOHMRXPA-UHFFFAOYSA-N
XLogP2.49
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine?
The IUPAC name of 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine (CID 102767119) is 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine.
What is the SMILES notation for 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine?
The canonical SMILES for 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine is CN(c1ncc(N)s1)C1CCCCC1.
What is the InChIKey of 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine?
The InChIKey is QWUHLDLOHMRXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-13(8-5-3-2-4-6-8)10-12-7-9(11)14-10/h7-8H,2-6,11H2,1H3.
What are the key properties of 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine?
2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine has a molecular weight of 211.33 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclohexyl-2-N-methyl-1,3-thiazole-2,5-diamine is sourced from PubChem (CID 102767119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).