4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole

C11H18N2S — CID 62542496

IUPAC4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
SMILESCCc1nc(CC2CCCN2)sc1C
InChIInChI=1S/C11H18N2S/c1-3-10-8(2)14-11(13-10)7-9-5-4-6-12-9/h9,12H,3-7H2,1-2H3
InChIKeySLYWZJBSLMQSJH-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.31
Rot. Bonds3

About 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole

4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole (PubChem CID 62542496) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole.

Molecular Properties

Compound Name4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
PubChem CID62542496
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
SMILESCCc1nc(CC2CCCN2)sc1C
InChIInChI=1S/C11H18N2S/c1-3-10-8(2)14-11(13-10)7-9-5-4-6-12-9/h9,12H,3-7H2,1-2H3
InChIKeySLYWZJBSLMQSJH-UHFFFAOYSA-N
XLogP2.31
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclohexyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 116829047
4-bromo-5-ethyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 83694099
5-methyl-4-pyridin-3-yl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 116829043
4-(2-bromophenyl)-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 116829049
4-(furan-2-yl)-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 62632691
5-(1,1-difluoroethyl)-4-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 84803169
2-ethyl-5-methyl-4-pyrrolidin-2-yl-1,3-thiazole
CID 115020841
2-(pyrrolidin-2-ylmethyl)-1,3-benzothiazole
CID 61370741
4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
CID 105462178
5-(1,1-difluoroethyl)-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 84795515
2-(piperidin-2-ylmethyl)-4,5,6,7-tetrahydro-1,3-benzothiazole
CID 115041792
4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine
CID 83849476

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole?
The IUPAC name of 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole (CID 62542496) is 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole.
What is the SMILES notation for 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole?
The canonical SMILES for 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole is CCc1nc(CC2CCCN2)sc1C.
What is the InChIKey of 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole?
The InChIKey is SLYWZJBSLMQSJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-3-10-8(2)14-11(13-10)7-9-5-4-6-12-9/h9,12H,3-7H2,1-2H3.
What are the key properties of 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole?
4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole has a molecular weight of 210.35 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole is sourced from PubChem (CID 62542496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).