[(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol

C10H16N2OS — CID 62735343

IUPAC[(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol
SMILESCc1ncc(CN2CCC[C@@H]2CO)s1
InChIInChI=1S/C10H16N2OS/c1-8-11-5-10(14-8)6-12-4-2-3-9(12)7-13/h5,9,13H,2-4,6-7H2,1H3/t9-/m1/s1
InChIKeyCBVCLEFPGHGNCG-SECBINFHSA-N
MW212.32 g/mol
LogP1.41
Rot. Bonds3

About [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol

[(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol (PubChem CID 62735343) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol
PubChem CID62735343
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name[(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol
SMILESCc1ncc(CN2CCC[C@@H]2CO)s1
InChIInChI=1S/C10H16N2OS/c1-8-11-5-10(14-8)6-12-4-2-3-9(12)7-13/h5,9,13H,2-4,6-7H2,1H3/t9-/m1/s1
InChIKeyCBVCLEFPGHGNCG-SECBINFHSA-N
XLogP1.41
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol (CID 62735343) is [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol is Cc1ncc(CN2CCC[C@@H]2CO)s1.
What is the InChIKey of [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol?
The InChIKey is CBVCLEFPGHGNCG-SECBINFHSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8-11-5-10(14-8)6-12-4-2-3-9(12)7-13/h5,9,13H,2-4,6-7H2,1H3/t9-/m1/s1.
What are the key properties of [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol?
[(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol has a molecular weight of 212.32 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidin-2-yl]methanol is sourced from PubChem (CID 62735343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).