(6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol

C9H12N2O — CID 58717485

IUPAC(6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol
SMILESCN[C@@H]1Cc2cccnc2[C@@H]1O
InChIInChI=1S/C9H12N2O/c1-10-7-5-6-3-2-4-11-8(6)9(7)12/h2-4,7,9-10,12H,5H2,1H3/t7-,9-/m1/s1
InChIKeyPVNLJENVFPRTRI-VXNVDRBHSA-N
MW164.21 g/mol
LogP0.26
Rot. Bonds1

About (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol

(6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol (PubChem CID 58717485) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol.

Molecular Properties

Compound Name(6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol
PubChem CID58717485
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name(6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol
SMILESCN[C@@H]1Cc2cccnc2[C@@H]1O
InChIInChI=1S/C9H12N2O/c1-10-7-5-6-3-2-4-11-8(6)9(7)12/h2-4,7,9-10,12H,5H2,1H3/t7-,9-/m1/s1
InChIKeyPVNLJENVFPRTRI-VXNVDRBHSA-N
XLogP0.26
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol?
The IUPAC name of (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol (CID 58717485) is (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol.
What is the SMILES notation for (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol?
The canonical SMILES for (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol is CN[C@@H]1Cc2cccnc2[C@@H]1O.
What is the InChIKey of (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol?
The InChIKey is PVNLJENVFPRTRI-VXNVDRBHSA-N. The full InChI is InChI=1S/C9H12N2O/c1-10-7-5-6-3-2-4-11-8(6)9(7)12/h2-4,7,9-10,12H,5H2,1H3/t7-,9-/m1/s1.
What are the key properties of (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol?
(6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol has a molecular weight of 164.21 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R,7R)-6-(methylamino)-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol is sourced from PubChem (CID 58717485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).