(3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol

C10H15N3O2 — CID 129359554

IUPAC(3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol
SMILESCO[C@@H]1CN(c2ncccc2N)C[C@H]1O
InChIInChI=1S/C10H15N3O2/c1-15-9-6-13(5-8(9)14)10-7(11)3-2-4-12-10/h2-4,8-9,14H,5-6,11H2,1H3/t8-,9-/m1/s1
InChIKeyHGQFEAFLPSPHTJ-RKDXNWHRSA-N
MW209.25 g/mol
LogP-0.14
Rot. Bonds2

About (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol

(3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol (PubChem CID 129359554) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol.

Molecular Properties

Compound Name(3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol
PubChem CID129359554
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name(3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol
SMILESCO[C@@H]1CN(c2ncccc2N)C[C@H]1O
InChIInChI=1S/C10H15N3O2/c1-15-9-6-13(5-8(9)14)10-7(11)3-2-4-12-10/h2-4,8-9,14H,5-6,11H2,1H3/t8-,9-/m1/s1
InChIKeyHGQFEAFLPSPHTJ-RKDXNWHRSA-N
XLogP-0.14
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol?
The IUPAC name of (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol (CID 129359554) is (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol.
What is the SMILES notation for (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol?
The canonical SMILES for (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol is CO[C@@H]1CN(c2ncccc2N)C[C@H]1O.
What is the InChIKey of (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol?
The InChIKey is HGQFEAFLPSPHTJ-RKDXNWHRSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-15-9-6-13(5-8(9)14)10-7(11)3-2-4-12-10/h2-4,8-9,14H,5-6,11H2,1H3/t8-,9-/m1/s1.
What are the key properties of (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol?
(3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol has a molecular weight of 209.25 g/mol, XLogP of -0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-1-(3-amino-2-pyridinyl)-4-methoxypyrrolidin-3-ol is sourced from PubChem (CID 129359554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).