(2R)-N-methoxypyrrolidin-2-amine

C5H12N2O — CID 161349886

IUPAC(2R)-N-methoxypyrrolidin-2-amine
SMILESCON[C@@H]1CCCN1
InChIInChI=1S/C5H12N2O/c1-8-7-5-3-2-4-6-5/h5-7H,2-4H2,1H3/t5-/m1/s1
InChIKeyVNUGLAQPIOASLZ-RXMQYKEDSA-N
MW116.16 g/mol
LogP-0.15
Rot. Bonds2

About (2R)-N-methoxypyrrolidin-2-amine

(2R)-N-methoxypyrrolidin-2-amine (PubChem CID 161349886) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is (2R)-N-methoxypyrrolidin-2-amine.

Molecular Properties

Compound Name(2R)-N-methoxypyrrolidin-2-amine
PubChem CID161349886
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Name(2R)-N-methoxypyrrolidin-2-amine
SMILESCON[C@@H]1CCCN1
InChIInChI=1S/C5H12N2O/c1-8-7-5-3-2-4-6-5/h5-7H,2-4H2,1H3/t5-/m1/s1
InChIKeyVNUGLAQPIOASLZ-RXMQYKEDSA-N
XLogP-0.15
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-methoxypyrrolidin-2-amine?
The IUPAC name of (2R)-N-methoxypyrrolidin-2-amine (CID 161349886) is (2R)-N-methoxypyrrolidin-2-amine.
What is the SMILES notation for (2R)-N-methoxypyrrolidin-2-amine?
The canonical SMILES for (2R)-N-methoxypyrrolidin-2-amine is CON[C@@H]1CCCN1.
What is the InChIKey of (2R)-N-methoxypyrrolidin-2-amine?
The InChIKey is VNUGLAQPIOASLZ-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H12N2O/c1-8-7-5-3-2-4-6-5/h5-7H,2-4H2,1H3/t5-/m1/s1.
What are the key properties of (2R)-N-methoxypyrrolidin-2-amine?
(2R)-N-methoxypyrrolidin-2-amine has a molecular weight of 116.16 g/mol, XLogP of -0.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methoxypyrrolidin-2-amine is sourced from PubChem (CID 161349886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).