(2R)-pyrrolidine-1,2-diamine

C4H11N3 — CID 54246028

IUPAC(2R)-pyrrolidine-1,2-diamine
SMILESN[C@H]1CCCN1N
InChIInChI=1S/C4H11N3/c5-4-2-1-3-7(4)6/h4H,1-3,5-6H2/t4-/m1/s1
InChIKeyQTIGIRGXJBYVTC-SCSAIBSYSA-N
MW101.15 g/mol
LogP-0.76
Rot. Bonds

About (2R)-pyrrolidine-1,2-diamine

(2R)-pyrrolidine-1,2-diamine (PubChem CID 54246028) has the molecular formula C4H11N3 and a molecular weight of 101.15 g/mol. Its IUPAC name is (2R)-pyrrolidine-1,2-diamine.

Molecular Properties

Compound Name(2R)-pyrrolidine-1,2-diamine
PubChem CID54246028
Molecular FormulaC4H11N3
Molecular Weight101.15 g/mol
Exact Mass101.10
IUPAC Name(2R)-pyrrolidine-1,2-diamine
SMILESN[C@H]1CCCN1N
InChIInChI=1S/C4H11N3/c5-4-2-1-3-7(4)6/h4H,1-3,5-6H2/t4-/m1/s1
InChIKeyQTIGIRGXJBYVTC-SCSAIBSYSA-N
XLogP-0.76
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-pyrrolidine-1,2-diamine?
The IUPAC name of (2R)-pyrrolidine-1,2-diamine (CID 54246028) is (2R)-pyrrolidine-1,2-diamine.
What is the SMILES notation for (2R)-pyrrolidine-1,2-diamine?
The canonical SMILES for (2R)-pyrrolidine-1,2-diamine is N[C@H]1CCCN1N.
What is the InChIKey of (2R)-pyrrolidine-1,2-diamine?
The InChIKey is QTIGIRGXJBYVTC-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H11N3/c5-4-2-1-3-7(4)6/h4H,1-3,5-6H2/t4-/m1/s1.
What are the key properties of (2R)-pyrrolidine-1,2-diamine?
(2R)-pyrrolidine-1,2-diamine has a molecular weight of 101.15 g/mol, XLogP of -0.76, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-pyrrolidine-1,2-diamine is sourced from PubChem (CID 54246028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).