(2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide

C9H18N2O2 — CID 141114850

IUPAC(2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide
SMILES[2H]CN1CCC[C@@]1(C[C@@H](C)O)C(N)=O
InChIInChI=1S/C9H18N2O2/c1-7(12)6-9(8(10)13)4-3-5-11(9)2/h7,12H,3-6H2,1-2H3,(H2,10,13)/t7-,9-/m1/s1/i2D
InChIKeyXDAJIDKGEQJRDN-QSDOOBBZSA-N
MW187.26 g/mol
LogP-0.29
Rot. Bonds4

About (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide

(2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide (PubChem CID 141114850) has the molecular formula C9H18N2O2 and a molecular weight of 187.26 g/mol. Its IUPAC name is (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide
PubChem CID141114850
Molecular FormulaC9H18N2O2
Molecular Weight187.26 g/mol
Exact Mass187.14
IUPAC Name(2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide
SMILES[2H]CN1CCC[C@@]1(C[C@@H](C)O)C(N)=O
InChIInChI=1S/C9H18N2O2/c1-7(12)6-9(8(10)13)4-3-5-11(9)2/h7,12H,3-6H2,1-2H3,(H2,10,13)/t7-,9-/m1/s1/i2D
InChIKeyXDAJIDKGEQJRDN-QSDOOBBZSA-N
XLogP-0.29
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.26
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide 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 (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide (CID 141114850) is (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide is [2H]CN1CCC[C@@]1(C[C@@H](C)O)C(N)=O.
What is the InChIKey of (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide?
The InChIKey is XDAJIDKGEQJRDN-QSDOOBBZSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-7(12)6-9(8(10)13)4-3-5-11(9)2/h7,12H,3-6H2,1-2H3,(H2,10,13)/t7-,9-/m1/s1/i2D.
What are the key properties of (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide?
(2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide has a molecular weight of 187.26 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(deuteriomethyl)-2-[(2R)-2-hydroxypropyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 141114850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).