3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one

C11H15N5O — CID 142728717

IUPAC3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one
SMILESNc1nn(C2CCNCC2)c2cc[nH]c(=O)c12
InChIInChI=1S/C11H15N5O/c12-10-9-8(3-6-14-11(9)17)16(15-10)7-1-4-13-5-2-7/h3,6-7,13H,1-2,4-5H2,(H2,12,15)(H,14,17)
InChIKeyIWPRPIDXJWTROT-UHFFFAOYSA-N
MW233.27 g/mol
LogP0.23
Rot. Bonds1

About 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one

3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one (PubChem CID 142728717) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one.

Molecular Properties

Compound Name3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one
PubChem CID142728717
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one
SMILESNc1nn(C2CCNCC2)c2cc[nH]c(=O)c12
InChIInChI=1S/C11H15N5O/c12-10-9-8(3-6-14-11(9)17)16(15-10)7-1-4-13-5-2-7/h3,6-7,13H,1-2,4-5H2,(H2,12,15)(H,14,17)
InChIKeyIWPRPIDXJWTROT-UHFFFAOYSA-N
XLogP0.23
TPSA88.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 50.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one?
The IUPAC name of 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one (CID 142728717) is 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one.
What is the SMILES notation for 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one?
The canonical SMILES for 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one is Nc1nn(C2CCNCC2)c2cc[nH]c(=O)c12.
What is the InChIKey of 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one?
The InChIKey is IWPRPIDXJWTROT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c12-10-9-8(3-6-14-11(9)17)16(15-10)7-1-4-13-5-2-7/h3,6-7,13H,1-2,4-5H2,(H2,12,15)(H,14,17).
What are the key properties of 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one?
3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one has a molecular weight of 233.27 g/mol, XLogP of 0.23, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-piperidin-4-yl-5H-pyrazolo[4,3-c]pyridin-4-one is sourced from PubChem (CID 142728717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).