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

C8H10N4S — CID 79046614

IUPACN-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine
SMILESCc1[nH]cnc1CNc1nccs1
InChIInChI=1S/C8H10N4S/c1-6-7(12-5-11-6)4-10-8-9-2-3-13-8/h2-3,5H,4H2,1H3,(H,9,10)(H,11,12)
InChIKeyPHCAUEUDPVNBQQ-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.79
Rot. Bonds3

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

N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine (PubChem CID 79046614) has the molecular formula C8H10N4S and a molecular weight of 194.26 g/mol. Its IUPAC name is N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine
PubChem CID79046614
Molecular FormulaC8H10N4S
Molecular Weight194.26 g/mol
Exact Mass194.06
IUPAC NameN-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine
SMILESCc1[nH]cnc1CNc1nccs1
InChIInChI=1S/C8H10N4S/c1-6-7(12-5-11-6)4-10-8-9-2-3-13-8/h2-3,5H,4H2,1H3,(H,9,10)(H,11,12)
InChIKeyPHCAUEUDPVNBQQ-UHFFFAOYSA-N
XLogP1.79
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methyl-1H-imidazol-4-yl)methyl]pyrimidin-5-amine
CID 107587844
5-methyl-N-(1,3-thiazol-2-yl)-1H-imidazole-4-carboxamide
CID 110684009
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1,3-thiazol-2-amine
CID 79048062
N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-amine
CID 60754232
N-[(3-methylfuran-2-yl)methyl]-1,3-thiazol-2-amine
CID 115924599
2-methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]-1-thiophen-2-ylpropan-1-amine
CID 62749583
2,3-difluoro-N-[(5-methyl-1H-imidazol-4-yl)methyl]aniline
CID 62741383
N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 4711878
methyl-N-[(5-methyl-1H-imidazol-4-yl)methyl]boronamidic acid
CID 20634568
N-[(1-methylcyclopropyl)methyl]-1,3-thiazol-2-amine
CID 107143585
N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-pyrazol-1-ylaniline
CID 55114545
N-[(5-methyl-1H-imidazol-4-yl)methyl]quinolin-6-amine
CID 62743051

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine (CID 79046614) is N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine is Cc1[nH]cnc1CNc1nccs1.
What is the InChIKey of N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine?
The InChIKey is PHCAUEUDPVNBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4S/c1-6-7(12-5-11-6)4-10-8-9-2-3-13-8/h2-3,5H,4H2,1H3,(H,9,10)(H,11,12).
What are the key properties of N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine?
N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine has a molecular weight of 194.26 g/mol, XLogP of 1.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 79046614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).