4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine

C8H10N4S — CID 43137964

IUPAC4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine
SMILESCc1nccn1Cc1csc(N)n1
InChIInChI=1S/C8H10N4S/c1-6-10-2-3-12(6)4-7-5-13-8(9)11-7/h2-3,5H,4H2,1H3,(H2,9,11)
InChIKeyCSIZSYGKCQAQOZ-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.28
Rot. Bonds2

About 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine

4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine (PubChem CID 43137964) has the molecular formula C8H10N4S and a molecular weight of 194.26 g/mol. Its IUPAC name is 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine
PubChem CID43137964
Molecular FormulaC8H10N4S
Molecular Weight194.26 g/mol
Exact Mass194.06
IUPAC Name4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine
SMILESCc1nccn1Cc1csc(N)n1
InChIInChI=1S/C8H10N4S/c1-6-10-2-3-12(6)4-7-5-13-8(9)11-7/h2-3,5H,4H2,1H3,(H2,9,11)
InChIKeyCSIZSYGKCQAQOZ-UHFFFAOYSA-N
XLogP1.28
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(2-amino-1,3-thiazol-4-yl)methyl]-3-ethylimidazol-2-one
CID 80581119
1-[(2-amino-1,3-thiazol-4-yl)methyl]-3-methylimidazol-2-one
CID 80581145
4-[(3,5-dimethyl-1,2,4-triazol-1-yl)methyl]-1,3-thiazol-2-amine
CID 61320183
2-[2-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-4-yl]acetic acid
CID 84818107
3-[(2-amino-1,3-thiazol-4-yl)methyl]-5-iodo-6-methylpyrimidin-4-one
CID 66341564
4-(chloromethyl)-2-[4-[(2-methylimidazol-1-yl)methyl]phenyl]-1,3-thiazole
CID 43320562
6-[(2-methylimidazol-1-yl)methyl]imidazo[2,1-b][1,3]thiazole
CID 78918699
5-[(2-amino-1,3-thiazol-4-yl)methyl]-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104735002
[6-[(2-methylimidazol-1-yl)methyl]-2-pyridinyl]hydrazine
CID 79231218
[1-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]imidazol-2-yl]methanamine
CID 62222485
1-[(2-amino-1,3-thiazol-4-yl)methyl]pyridin-4-one
CID 62880002
2-[(2-methylimidazol-1-yl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 55046528

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine (CID 43137964) is 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine is Cc1nccn1Cc1csc(N)n1.
What is the InChIKey of 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine?
The InChIKey is CSIZSYGKCQAQOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4S/c1-6-10-2-3-12(6)4-7-5-13-8(9)11-7/h2-3,5H,4H2,1H3,(H2,9,11).
What are the key properties of 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine?
4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine has a molecular weight of 194.26 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylimidazol-1-yl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 43137964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).