(2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol

C10H16N2OS — CID 103896926

IUPAC(2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol
SMILESC[C@H](CO)NCc1nc2c(s1)CCC2
InChIInChI=1S/C10H16N2OS/c1-7(6-13)11-5-10-12-8-3-2-4-9(8)14-10/h7,11,13H,2-6H2,1H3/t7-/m1/s1
InChIKeyHFHZOTGUVDOCOV-SSDOTTSWSA-N
MW212.32 g/mol
LogP1.10
Rot. Bonds4

About (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol

(2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol (PubChem CID 103896926) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol.

Molecular Properties

Compound Name(2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol
PubChem CID103896926
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name(2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol
SMILESC[C@H](CO)NCc1nc2c(s1)CCC2
InChIInChI=1S/C10H16N2OS/c1-7(6-13)11-5-10-12-8-3-2-4-9(8)14-10/h7,11,13H,2-6H2,1H3/t7-/m1/s1
InChIKeyHFHZOTGUVDOCOV-SSDOTTSWSA-N
XLogP1.10
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol?
The IUPAC name of (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol (CID 103896926) is (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol.
What is the SMILES notation for (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol?
The canonical SMILES for (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol is C[C@H](CO)NCc1nc2c(s1)CCC2.
What is the InChIKey of (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol?
The InChIKey is HFHZOTGUVDOCOV-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7(6-13)11-5-10-12-8-3-2-4-9(8)14-10/h7,11,13H,2-6H2,1H3/t7-/m1/s1.
What are the key properties of (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol?
(2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol has a molecular weight of 212.32 g/mol, XLogP of 1.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylmethylamino)propan-1-ol is sourced from PubChem (CID 103896926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).