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

C9H12N4S — CID 82873661

IUPAC4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine
SMILESCc1csc(NCc2ccn(C)n2)n1
InChIInChI=1S/C9H12N4S/c1-7-6-14-9(11-7)10-5-8-3-4-13(2)12-8/h3-4,6H,5H2,1-2H3,(H,10,11)
InChIKeyFTBCVWVMDYPKSR-UHFFFAOYSA-N
MW208.29 g/mol
LogP1.80
Rot. Bonds3

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

4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine (PubChem CID 82873661) has the molecular formula C9H12N4S and a molecular weight of 208.29 g/mol. Its IUPAC name is 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine
PubChem CID82873661
Molecular FormulaC9H12N4S
Molecular Weight208.29 g/mol
Exact Mass208.08
IUPAC Name4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine
SMILESCc1csc(NCc2ccn(C)n2)n1
InChIInChI=1S/C9H12N4S/c1-7-6-14-9(11-7)10-5-8-3-4-13(2)12-8/h3-4,6H,5H2,1-2H3,(H,10,11)
InChIKeyFTBCVWVMDYPKSR-UHFFFAOYSA-N
XLogP1.80
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-N-[2-(1-methylpyrazol-3-yl)ethyl]-1,3-thiazol-2-amine
CID 106105461
ethyl 3-[2-[(1-methylpyrazol-3-yl)methylamino]-1,3-thiazol-4-yl]propanoate
CID 103488356
5-ethyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 115924669
4-methyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine
CID 79242424
N-[(1-methylpyrazol-3-yl)methyl]-3-propan-2-yl-1,2,4-thiadiazol-5-amine
CID 82872726
4-N-[(1-methylpyrazol-3-yl)methyl]benzene-1,4-diamine
CID 82882084
2,5-dimethyl-N-[(1-methylpyrazol-3-yl)methyl]pyrazol-3-amine;hydrochloride
CID 126965380
N-methyl-1-(1-methylpyrazol-3-yl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-amine
CID 82877070
4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
CID 60723741
4-methyl-N-[2-(1,2,4-triazol-4-yl)ethyl]-1,3-thiazol-2-amine
CID 131020952
6-methyl-2-[(1-methylpyrazol-3-yl)methylamino]pyridine-3-carbonitrile
CID 82873619
6-chloro-2-methyl-N-[(1-methylpyrazol-3-yl)methyl]pyrimidin-4-amine
CID 82873713

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine (CID 82873661) is 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine is Cc1csc(NCc2ccn(C)n2)n1.
What is the InChIKey of 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine?
The InChIKey is FTBCVWVMDYPKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4S/c1-7-6-14-9(11-7)10-5-8-3-4-13(2)12-8/h3-4,6H,5H2,1-2H3,(H,10,11).
What are the key properties of 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine?
4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine has a molecular weight of 208.29 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 82873661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).