N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine

C12H20N2OS — CID 102633424

IUPACN-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine
SMILESCNC1CCCCC1OCc1cnc(C)s1
InChIInChI=1S/C12H20N2OS/c1-9-14-7-10(16-9)8-15-12-6-4-3-5-11(12)13-2/h7,11-13H,3-6,8H2,1-2H3
InChIKeyCQDITLGCVXEEHA-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.50
Rot. Bonds4

About N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine

N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine (PubChem CID 102633424) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine
PubChem CID102633424
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC NameN-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine
SMILESCNC1CCCCC1OCc1cnc(C)s1
InChIInChI=1S/C12H20N2OS/c1-9-14-7-10(16-9)8-15-12-6-4-3-5-11(12)13-2/h7,11-13H,3-6,8H2,1-2H3
InChIKeyCQDITLGCVXEEHA-UHFFFAOYSA-N
XLogP2.50
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-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-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine?
The IUPAC name of N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine (CID 102633424) is N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine.
What is the SMILES notation for N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine?
The canonical SMILES for N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine is CNC1CCCCC1OCc1cnc(C)s1.
What is the InChIKey of N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine?
The InChIKey is CQDITLGCVXEEHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-9-14-7-10(16-9)8-15-12-6-4-3-5-11(12)13-2/h7,11-13H,3-6,8H2,1-2H3.
What are the key properties of N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine?
N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine has a molecular weight of 240.37 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(2-methyl-1,3-thiazol-5-yl)methoxy]cyclohexan-1-amine is sourced from PubChem (CID 102633424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).