(2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide

C7H14N2O3 — CID 10954013

IUPAC(2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide
SMILESNC(=O)N1[C@@H](CCO)CC[C@H]1O
InChIInChI=1S/C7H14N2O3/c8-7(12)9-5(3-4-10)1-2-6(9)11/h5-6,10-11H,1-4H2,(H2,8,12)/t5-,6-/m1/s1
InChIKeyFRBGGXLYBCOTRD-PHDIDXHHSA-N
MW174.20 g/mol
LogP-0.77
Rot. Bonds2

About (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide

(2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide (PubChem CID 10954013) has the molecular formula C7H14N2O3 and a molecular weight of 174.20 g/mol. Its IUPAC name is (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide
PubChem CID10954013
Molecular FormulaC7H14N2O3
Molecular Weight174.20 g/mol
Exact Mass174.10
IUPAC Name(2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide
SMILESNC(=O)N1[C@@H](CCO)CC[C@H]1O
InChIInChI=1S/C7H14N2O3/c8-7(12)9-5(3-4-10)1-2-6(9)11/h5-6,10-11H,1-4H2,(H2,8,12)/t5-,6-/m1/s1
InChIKeyFRBGGXLYBCOTRD-PHDIDXHHSA-N
XLogP-0.77
TPSA86.79 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-0.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide?
The IUPAC name of (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide (CID 10954013) is (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide is NC(=O)N1[C@@H](CCO)CC[C@H]1O.
What is the InChIKey of (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide?
The InChIKey is FRBGGXLYBCOTRD-PHDIDXHHSA-N. The full InChI is InChI=1S/C7H14N2O3/c8-7(12)9-5(3-4-10)1-2-6(9)11/h5-6,10-11H,1-4H2,(H2,8,12)/t5-,6-/m1/s1.
What are the key properties of (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide?
(2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide has a molecular weight of 174.20 g/mol, XLogP of -0.77, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-2-hydroxy-5-(2-hydroxyethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 10954013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).