(1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol

C10H14N2O2 — CID 123989145

IUPAC(1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol
SMILESC[C@H]1C[C@@H](Oc2ccncn2)C[C@@H]1O
InChIInChI=1S/C10H14N2O2/c1-7-4-8(5-9(7)13)14-10-2-3-11-6-12-10/h2-3,6-9,13H,4-5H2,1H3/t7-,8+,9-/m0/s1
InChIKeyUHVYIAHKYAODOY-YIZRAAEISA-N
MW194.23 g/mol
LogP1.01
Rot. Bonds2

About (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol

(1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol (PubChem CID 123989145) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol.

Molecular Properties

Compound Name(1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol
PubChem CID123989145
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol
SMILESC[C@H]1C[C@@H](Oc2ccncn2)C[C@@H]1O
InChIInChI=1S/C10H14N2O2/c1-7-4-8(5-9(7)13)14-10-2-3-11-6-12-10/h2-3,6-9,13H,4-5H2,1H3/t7-,8+,9-/m0/s1
InChIKeyUHVYIAHKYAODOY-YIZRAAEISA-N
XLogP1.01
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol?
The IUPAC name of (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol (CID 123989145) is (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol.
What is the SMILES notation for (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol?
The canonical SMILES for (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol is C[C@H]1C[C@@H](Oc2ccncn2)C[C@@H]1O.
What is the InChIKey of (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol?
The InChIKey is UHVYIAHKYAODOY-YIZRAAEISA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7-4-8(5-9(7)13)14-10-2-3-11-6-12-10/h2-3,6-9,13H,4-5H2,1H3/t7-,8+,9-/m0/s1.
What are the key properties of (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol?
(1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol has a molecular weight of 194.23 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2S,4R)-2-methyl-4-pyrimidin-4-yloxycyclopentan-1-ol is sourced from PubChem (CID 123989145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).