(2R,4R)-4-aminopyrrolidine-2-carboxamide

C5H11N3O — CID 58079537

IUPAC(2R,4R)-4-aminopyrrolidine-2-carboxamide
SMILESNC(=O)[C@H]1C[C@@H](N)CN1
InChIInChI=1S/C5H11N3O/c6-3-1-4(5(7)9)8-2-3/h3-4,8H,1-2,6H2,(H2,7,9)/t3-,4-/m1/s1
InChIKeyCTUKFYWXYDCLIT-QWWZWVQMSA-N
MW129.16 g/mol
LogP-1.84
Rot. Bonds1

About (2R,4R)-4-aminopyrrolidine-2-carboxamide

(2R,4R)-4-aminopyrrolidine-2-carboxamide (PubChem CID 58079537) has the molecular formula C5H11N3O and a molecular weight of 129.16 g/mol. Its IUPAC name is (2R,4R)-4-aminopyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R,4R)-4-aminopyrrolidine-2-carboxamide
PubChem CID58079537
Molecular FormulaC5H11N3O
Molecular Weight129.16 g/mol
Exact Mass129.09
IUPAC Name(2R,4R)-4-aminopyrrolidine-2-carboxamide
SMILESNC(=O)[C@H]1C[C@@H](N)CN1
InChIInChI=1S/C5H11N3O/c6-3-1-4(5(7)9)8-2-3/h3-4,8H,1-2,6H2,(H2,7,9)/t3-,4-/m1/s1
InChIKeyCTUKFYWXYDCLIT-QWWZWVQMSA-N
XLogP-1.84
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-1.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,4R)-4-aminopyrrolidine-2-carboxamide?
The IUPAC name of (2R,4R)-4-aminopyrrolidine-2-carboxamide (CID 58079537) is (2R,4R)-4-aminopyrrolidine-2-carboxamide.
What is the SMILES notation for (2R,4R)-4-aminopyrrolidine-2-carboxamide?
The canonical SMILES for (2R,4R)-4-aminopyrrolidine-2-carboxamide is NC(=O)[C@H]1C[C@@H](N)CN1.
What is the InChIKey of (2R,4R)-4-aminopyrrolidine-2-carboxamide?
The InChIKey is CTUKFYWXYDCLIT-QWWZWVQMSA-N. The full InChI is InChI=1S/C5H11N3O/c6-3-1-4(5(7)9)8-2-3/h3-4,8H,1-2,6H2,(H2,7,9)/t3-,4-/m1/s1.
What are the key properties of (2R,4R)-4-aminopyrrolidine-2-carboxamide?
(2R,4R)-4-aminopyrrolidine-2-carboxamide has a molecular weight of 129.16 g/mol, XLogP of -1.84, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-4-aminopyrrolidine-2-carboxamide is sourced from PubChem (CID 58079537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).