(2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone

C15H24N2O2S — CID 99837210

IUPAC(2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone
SMILESCCC[C@]1(COC)CCCN1C(=O)c1sc(C)nc1C
InChIInChI=1S/C15H24N2O2S/c1-5-7-15(10-19-4)8-6-9-17(15)14(18)13-11(2)16-12(3)20-13/h5-10H2,1-4H3/t15-/m1/s1
InChIKeyPWRXULUPGXWZRO-OAHLLOKOSA-N
MW296.44 g/mol
LogP3.18
Rot. Bonds5

About (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone

(2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone (PubChem CID 99837210) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone
PubChem CID99837210
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name(2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone
SMILESCCC[C@]1(COC)CCCN1C(=O)c1sc(C)nc1C
InChIInChI=1S/C15H24N2O2S/c1-5-7-15(10-19-4)8-6-9-17(15)14(18)13-11(2)16-12(3)20-13/h5-10H2,1-4H3/t15-/m1/s1
InChIKeyPWRXULUPGXWZRO-OAHLLOKOSA-N
XLogP3.18
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone with MolForge

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Related Compounds

6-[(2R)-2-(methoxymethyl)-2-propylpyrrolidine-1-carbonyl]pyridine-2-carboxylic acid
CID 129470689
furan-3-yl-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone
CID 99837225
(2S)-2-(methoxymethyl)-N-[(2-methylpyrimidin-4-yl)methyl]-2-propylpyrrolidine-1-carboxamide
CID 99838832
(2R)-2-(methoxymethyl)-N-(5-propan-2-yl-1,3-thiazol-4-yl)-2-propylpyrrolidine-1-carboxamide
CID 164639811
(2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-[(2R)-1-ethylpyrrolidin-2-yl]pyrrolidin-1-yl]methanone
CID 129430279
(2,4-dimethyl-1,3-thiazol-5-yl)-[2-methyl-2-[4-methyl-6-(methylamino)pyrimidin-2-yl]pyrrolidin-1-yl]methanone
CID 127245527
[2-(methoxymethyl)-2-propylpyrrolidin-1-yl]-[4-methoxy-3-(tetrazol-1-yl)phenyl]methanone
CID 126804442
(2,4-dimethyl-1,3-thiazol-5-yl)-[4-hydroxy-4-(phenoxymethyl)piperidin-1-yl]methanone
CID 155990994
(2,4-dimethyl-1,3-thiazol-5-yl)-[4-(ethylaminomethyl)piperidin-1-yl]methanone
CID 103807604
8-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-2-(3-methoxypropyl)-2,8-diazaspiro[4.5]decan-3-one
CID 72927770
(2S)-2-(methoxymethyl)-2-propyl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]pyrrolidine-1-carboxamide
CID 99842418
cyclopentyl-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperazin-1-yl]methanone
CID 36515172

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone?
The IUPAC name of (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone (CID 99837210) is (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone.
What is the SMILES notation for (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone?
The canonical SMILES for (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone is CCC[C@]1(COC)CCCN1C(=O)c1sc(C)nc1C.
What is the InChIKey of (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone?
The InChIKey is PWRXULUPGXWZRO-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-5-7-15(10-19-4)8-6-9-17(15)14(18)13-11(2)16-12(3)20-13/h5-10H2,1-4H3/t15-/m1/s1.
What are the key properties of (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone?
(2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone has a molecular weight of 296.44 g/mol, XLogP of 3.18, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethyl-1,3-thiazol-5-yl)-[(2R)-2-(methoxymethyl)-2-propylpyrrolidin-1-yl]methanone is sourced from PubChem (CID 99837210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).