4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole

C8H12N2OS — CID 62347813

IUPAC4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole
SMILESCc1csc(OC2CCNC2)n1
InChIInChI=1S/C8H12N2OS/c1-6-5-12-8(10-6)11-7-2-3-9-4-7/h5,7,9H,2-4H2,1H3
InChIKeyBBNVHIDXQIFOKH-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.19
Rot. Bonds2

About 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole

4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole (PubChem CID 62347813) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole.

Molecular Properties

Compound Name4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole
PubChem CID62347813
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole
SMILESCc1csc(OC2CCNC2)n1
InChIInChI=1S/C8H12N2OS/c1-6-5-12-8(10-6)11-7-2-3-9-4-7/h5,7,9H,2-4H2,1H3
InChIKeyBBNVHIDXQIFOKH-UHFFFAOYSA-N
XLogP1.19
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-bromo-2-pyrrolidin-3-yloxy-1,3-thiazole
CID 79400429
4-methyl-2-[(3R)-pyrrolidin-3-yl]-1,3-thiazole
CID 93492448
2-methyl-6-[(3R)-pyrrolidin-3-yl]oxypyridine
CID 94406823
5-pyrrolidin-3-yloxy-1,2,4-thiadiazole
CID 65275097
4-methyl-2-pyrrolidin-3-yloxypyrimidine;hydrochloride
CID 71639242
3-methyl-6-[(3S)-pyrrolidin-3-yl]oxypyridazine
CID 71638804
(3S)-3-(3,5-dimethylphenoxy)pyrrolidine
CID 26192104
4-methyl-2-piperidin-4-yl-1,3-thiazole
CID 23404938
2-chloro-4-methyl-6-pyrrolidin-3-yloxypyrimidine;hydrochloride
CID 71638580
4-chloro-6-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyrimidine;hydrochloride
CID 71638490
4-chloro-2-(4-methylpiperidin-3-yl)oxy-1,3-thiazole
CID 102954585
5-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyrimidine
CID 95031425

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole?
The IUPAC name of 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole (CID 62347813) is 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole.
What is the SMILES notation for 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole?
The canonical SMILES for 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole is Cc1csc(OC2CCNC2)n1.
What is the InChIKey of 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole?
The InChIKey is BBNVHIDXQIFOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-6-5-12-8(10-6)11-7-2-3-9-4-7/h5,7,9H,2-4H2,1H3.
What are the key properties of 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole?
4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole has a molecular weight of 184.26 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-pyrrolidin-3-yloxy-1,3-thiazole is sourced from PubChem (CID 62347813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).