(4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one

C9H16N2O2 — CID 10749987

IUPAC(4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one
SMILESO=C1C[C@H]([C@@H]2C[C@@H](O)CN2)CCN1
InChIInChI=1S/C9H16N2O2/c12-7-4-8(11-5-7)6-1-2-10-9(13)3-6/h6-8,11-12H,1-5H2,(H,10,13)/t6-,7-,8+/m1/s1
InChIKeyNXEHNTQMFGAWOU-PRJMDXOYSA-N
MW184.24 g/mol
LogP-0.76
Rot. Bonds1

About (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one

(4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one (PubChem CID 10749987) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one.

Molecular Properties

Compound Name(4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one
PubChem CID10749987
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name(4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one
SMILESO=C1C[C@H]([C@@H]2C[C@@H](O)CN2)CCN1
InChIInChI=1S/C9H16N2O2/c12-7-4-8(11-5-7)6-1-2-10-9(13)3-6/h6-8,11-12H,1-5H2,(H,10,13)/t6-,7-,8+/m1/s1
InChIKeyNXEHNTQMFGAWOU-PRJMDXOYSA-N
XLogP-0.76
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one 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 (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one?
The IUPAC name of (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one (CID 10749987) is (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one.
What is the SMILES notation for (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one?
The canonical SMILES for (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one is O=C1C[C@H]([C@@H]2C[C@@H](O)CN2)CCN1.
What is the InChIKey of (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one?
The InChIKey is NXEHNTQMFGAWOU-PRJMDXOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c12-7-4-8(11-5-7)6-1-2-10-9(13)3-6/h6-8,11-12H,1-5H2,(H,10,13)/t6-,7-,8+/m1/s1.
What are the key properties of (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one?
(4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one has a molecular weight of 184.24 g/mol, XLogP of -0.76, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[(2S,4R)-4-hydroxypyrrolidin-2-yl]piperidin-2-one is sourced from PubChem (CID 10749987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).