N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine

C11H19N3S — CID 167262274

IUPACN-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine
SMILESCNc1cnc(C2CCC(NC)CC2)s1
InChIInChI=1S/C11H19N3S/c1-12-9-5-3-8(4-6-9)11-14-7-10(13-2)15-11/h7-9,12-13H,3-6H2,1-2H3
InChIKeyNKZCXKXBLBICMT-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.43
Rot. Bonds3

About N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine

N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine (PubChem CID 167262274) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine.

Molecular Properties

Compound NameN-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine
PubChem CID167262274
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC NameN-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine
SMILESCNc1cnc(C2CCC(NC)CC2)s1
InChIInChI=1S/C11H19N3S/c1-12-9-5-3-8(4-6-9)11-14-7-10(13-2)15-11/h7-9,12-13H,3-6H2,1-2H3
InChIKeyNKZCXKXBLBICMT-UHFFFAOYSA-N
XLogP2.43
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-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-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine?
The IUPAC name of N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine (CID 167262274) is N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine.
What is the SMILES notation for N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine?
The canonical SMILES for N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine is CNc1cnc(C2CCC(NC)CC2)s1.
What is the InChIKey of N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine?
The InChIKey is NKZCXKXBLBICMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-12-9-5-3-8(4-6-9)11-14-7-10(13-2)15-11/h7-9,12-13H,3-6H2,1-2H3.
What are the key properties of N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine?
N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine has a molecular weight of 225.36 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[4-(methylamino)cyclohexyl]-1,3-thiazol-5-amine is sourced from PubChem (CID 167262274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).