1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol

C10H14N2OS — CID 131062597

IUPAC1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol
SMILESOC1(c2ccns2)CCN(C2CC2)C1
InChIInChI=1S/C10H14N2OS/c13-10(9-3-5-11-14-9)4-6-12(7-10)8-1-2-8/h3,5,8,13H,1-2,4,6-7H2
InChIKeyPURBCSXZYVYZEM-UHFFFAOYSA-N
MW210.30 g/mol
LogP1.20
Rot. Bonds2

About 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol

1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol (PubChem CID 131062597) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol
PubChem CID131062597
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol
SMILESOC1(c2ccns2)CCN(C2CC2)C1
InChIInChI=1S/C10H14N2OS/c13-10(9-3-5-11-14-9)4-6-12(7-10)8-1-2-8/h3,5,8,13H,1-2,4,6-7H2
InChIKeyPURBCSXZYVYZEM-UHFFFAOYSA-N
XLogP1.20
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Tert-butyl-3-(1,2-thiazol-5-yl)azetidin-3-ol
CID 164764062
1-Methyl-3-(3-methyl-1,2-thiazol-5-yl)pyrrolidin-3-ol
CID 130874616
4-(1,2-Thiazol-5-yl)-1-azabicyclo[3.2.1]octan-4-ol
CID 130942811
1-Methyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol
CID 130952205
5-Isothiazolemethanol, I+/--methyl-I+/--(2-pyrrolidinylmethyl)-
CID 130975146
1-(1,2-Thiazol-5-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-ol
CID 130986278
1,2-Dimethyl-4-(1,2-thiazol-5-yl)piperidin-4-ol
CID 131059679
1,5-Dimethyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol
CID 131150996

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol?
The IUPAC name of 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol (CID 131062597) is 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol.
What is the SMILES notation for 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol?
The canonical SMILES for 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol is OC1(c2ccns2)CCN(C2CC2)C1.
What is the InChIKey of 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol?
The InChIKey is PURBCSXZYVYZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2OS/c13-10(9-3-5-11-14-9)4-6-12(7-10)8-1-2-8/h3,5,8,13H,1-2,4,6-7H2.
What are the key properties of 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol?
1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol has a molecular weight of 210.30 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(1,2-thiazol-5-yl)pyrrolidin-3-ol is sourced from PubChem (CID 131062597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).