1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine

C10H14N4S — CID 62741818

IUPAC1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine
SMILESCc1ncc(CNCc2csc(C)n2)[nH]1
InChIInChI=1S/C10H14N4S/c1-7-12-5-9(13-7)3-11-4-10-6-15-8(2)14-10/h5-6,11H,3-4H2,1-2H3,(H,12,13)
InChIKeyYMBNGAPUEJESIH-UHFFFAOYSA-N
MW222.32 g/mol
LogP1.77
Rot. Bonds4

About 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine

1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine (PubChem CID 62741818) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine
PubChem CID62741818
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine
SMILESCc1ncc(CNCc2csc(C)n2)[nH]1
InChIInChI=1S/C10H14N4S/c1-7-12-5-9(13-7)3-11-4-10-6-15-8(2)14-10/h5-6,11H,3-4H2,1-2H3,(H,12,13)
InChIKeyYMBNGAPUEJESIH-UHFFFAOYSA-N
XLogP1.77
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine?
The IUPAC name of 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine (CID 62741818) is 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine.
What is the SMILES notation for 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine?
The canonical SMILES for 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine is Cc1ncc(CNCc2csc(C)n2)[nH]1.
What is the InChIKey of 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine?
The InChIKey is YMBNGAPUEJESIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-7-12-5-9(13-7)3-11-4-10-6-15-8(2)14-10/h5-6,11H,3-4H2,1-2H3,(H,12,13).
What are the key properties of 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine?
1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine has a molecular weight of 222.32 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1H-imidazol-5-yl)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine is sourced from PubChem (CID 62741818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).