5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one

C14H19N3O — CID 102773865

IUPAC5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one
SMILESCN1CC(NC2CCc3cccnc32)CCC1=O
InChIInChI=1S/C14H19N3O/c1-17-9-11(5-7-13(17)18)16-12-6-4-10-3-2-8-15-14(10)12/h2-3,8,11-12,16H,4-7,9H2,1H3
InChIKeyJGWPYALPBLONBQ-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.28
Rot. Bonds2

About 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one

5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one (PubChem CID 102773865) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one.

Molecular Properties

Compound Name5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one
PubChem CID102773865
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one
SMILESCN1CC(NC2CCc3cccnc32)CCC1=O
InChIInChI=1S/C14H19N3O/c1-17-9-11(5-7-13(17)18)16-12-6-4-10-3-2-8-15-14(10)12/h2-3,8,11-12,16H,4-7,9H2,1H3
InChIKeyJGWPYALPBLONBQ-UHFFFAOYSA-N
XLogP1.28
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one?
The IUPAC name of 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one (CID 102773865) is 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one.
What is the SMILES notation for 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one?
The canonical SMILES for 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one is CN1CC(NC2CCc3cccnc32)CCC1=O.
What is the InChIKey of 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one?
The InChIKey is JGWPYALPBLONBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-17-9-11(5-7-13(17)18)16-12-6-4-10-3-2-8-15-14(10)12/h2-3,8,11-12,16H,4-7,9H2,1H3.
What are the key properties of 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one?
5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one has a molecular weight of 245.33 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-ylamino)-1-methylpiperidin-2-one is sourced from PubChem (CID 102773865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).