1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine

C10H13N3S2 — CID 59815006

IUPAC1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine
SMILESCc1ncc(CNCc2cnc(C)s2)s1
InChIInChI=1S/C10H13N3S2/c1-7-12-5-9(14-7)3-11-4-10-6-13-8(2)15-10/h5-6,11H,3-4H2,1-2H3
InChIKeyCTOCWDZGEHCMGS-UHFFFAOYSA-N
MW239.37 g/mol
LogP2.51
Rot. Bonds4

About 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine

1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine (PubChem CID 59815006) has the molecular formula C10H13N3S2 and a molecular weight of 239.37 g/mol. Its IUPAC name is 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine
PubChem CID59815006
Molecular FormulaC10H13N3S2
Molecular Weight239.37 g/mol
Exact Mass239.06
IUPAC Name1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine
SMILESCc1ncc(CNCc2cnc(C)s2)s1
InChIInChI=1S/C10H13N3S2/c1-7-12-5-9(14-7)3-11-4-10-6-13-8(2)15-10/h5-6,11H,3-4H2,1-2H3
InChIKeyCTOCWDZGEHCMGS-UHFFFAOYSA-N
XLogP2.51
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.37
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine 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 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine?
The IUPAC name of 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine (CID 59815006) is 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine.
What is the SMILES notation for 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine?
The canonical SMILES for 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine is Cc1ncc(CNCc2cnc(C)s2)s1.
What is the InChIKey of 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine?
The InChIKey is CTOCWDZGEHCMGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S2/c1-7-12-5-9(14-7)3-11-4-10-6-13-8(2)15-10/h5-6,11H,3-4H2,1-2H3.
What are the key properties of 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine?
1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine has a molecular weight of 239.37 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1,3-thiazol-5-yl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]methanamine is sourced from PubChem (CID 59815006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).