[(2S)-pyrrolidin-2-yl]methanamine

C5H12N2 — CID 2734054

IUPAC[(2S)-pyrrolidin-2-yl]methanamine
SMILESNC[C@@H]1CCCN1
InChIInChI=1S/C5H12N2/c6-4-5-2-1-3-7-5/h5,7H,1-4,6H2/t5-/m0/s1
InChIKeyAUKXFNABVHIUAC-YFKPBYRVSA-N
MW100.17 g/mol
LogP-0.30
Rot. Bonds1

About [(2S)-pyrrolidin-2-yl]methanamine

[(2S)-pyrrolidin-2-yl]methanamine (PubChem CID 2734054) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is [(2S)-pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[(2S)-pyrrolidin-2-yl]methanamine
PubChem CID2734054
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC Name[(2S)-pyrrolidin-2-yl]methanamine
SMILESNC[C@@H]1CCCN1
InChIInChI=1S/C5H12N2/c6-4-5-2-1-3-7-5/h5,7H,1-4,6H2/t5-/m0/s1
InChIKeyAUKXFNABVHIUAC-YFKPBYRVSA-N
XLogP-0.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2S)-pyrrolidin-2-yl]methanamine?
The IUPAC name of [(2S)-pyrrolidin-2-yl]methanamine (CID 2734054) is [(2S)-pyrrolidin-2-yl]methanamine.
What is the SMILES notation for [(2S)-pyrrolidin-2-yl]methanamine?
The canonical SMILES for [(2S)-pyrrolidin-2-yl]methanamine is NC[C@@H]1CCCN1.
What is the InChIKey of [(2S)-pyrrolidin-2-yl]methanamine?
The InChIKey is AUKXFNABVHIUAC-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H12N2/c6-4-5-2-1-3-7-5/h5,7H,1-4,6H2/t5-/m0/s1.
What are the key properties of [(2S)-pyrrolidin-2-yl]methanamine?
[(2S)-pyrrolidin-2-yl]methanamine has a molecular weight of 100.17 g/mol, XLogP of -0.30, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 2734054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).