5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine

C8H9ClN4S — CID 130727715

IUPAC5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine
SMILESClc1cnc(NCCc2cn[nH]c2)s1
InChIInChI=1S/C8H9ClN4S/c9-7-5-11-8(14-7)10-2-1-6-3-12-13-4-6/h3-5H,1-2H2,(H,10,11)(H,12,13)
InChIKeyYDGYPRZLXJLXOA-UHFFFAOYSA-N
MW228.71 g/mol
LogP2.17
Rot. Bonds4

About 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine

5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine (PubChem CID 130727715) has the molecular formula C8H9ClN4S and a molecular weight of 228.71 g/mol. Its IUPAC name is 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine
PubChem CID130727715
Molecular FormulaC8H9ClN4S
Molecular Weight228.71 g/mol
Exact Mass228.02
IUPAC Name5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine
SMILESClc1cnc(NCCc2cn[nH]c2)s1
InChIInChI=1S/C8H9ClN4S/c9-7-5-11-8(14-7)10-2-1-6-3-12-13-4-6/h3-5H,1-2H2,(H,10,11)(H,12,13)
InChIKeyYDGYPRZLXJLXOA-UHFFFAOYSA-N
XLogP2.17
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.71
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-4-amine
CID 130686344
4-[(5-chloro-1,3-thiazol-2-yl)amino]butan-2-ol
CID 126995503
1-methyl-2-[2-(1H-pyrazol-4-yl)ethyl]hydrazine
CID 144949085
N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine
CID 130658671
N-[2-(1H-pyrazol-4-yl)ethyl]-1,4,5,6-tetrahydropyrimidin-2-amine
CID 127014926
N-[2-(1H-pyrazol-4-yl)ethyl]acetamide
CID 126809556
2-(1H-pyrazol-4-yl)ethanethiol
CID 130569311
2-N-[2-(5-chlorothiophen-2-yl)ethyl]-1,3-thiazole-2,5-diamine
CID 106037262
5-bromo-N-(2-phenylethyl)-1,3-thiazol-2-amine
CID 25093341
1-amino-3-[2-(1H-pyrazol-4-yl)ethyl]thiourea
CID 127014953
5-chloro-N-[(4-methylthiophen-3-yl)methyl]-1,3-thiazol-2-amine
CID 130670323
3-[6-[2-(1H-pyrazol-4-yl)ethylamino]pyrimidin-4-yl]cyclobutan-1-ol
CID 91788433

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine (CID 130727715) is 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine is Clc1cnc(NCCc2cn[nH]c2)s1.
What is the InChIKey of 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine?
The InChIKey is YDGYPRZLXJLXOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN4S/c9-7-5-11-8(14-7)10-2-1-6-3-12-13-4-6/h3-5H,1-2H2,(H,10,11)(H,12,13).
What are the key properties of 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine?
5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine has a molecular weight of 228.71 g/mol, XLogP of 2.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 130727715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).