1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine

C14H21N5 — CID 106633425

IUPAC1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine
SMILESCc1nn(C)c2ncc(NCC3CCCCN3)cc12
InChIInChI=1S/C14H21N5/c1-10-13-7-12(9-17-14(13)19(2)18-10)16-8-11-5-3-4-6-15-11/h7,9,11,15-16H,3-6,8H2,1-2H3
InChIKeyRXVKQNQPNYYCDC-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.83
Rot. Bonds3

About 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine

1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine (PubChem CID 106633425) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine.

Molecular Properties

Compound Name1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine
PubChem CID106633425
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine
SMILESCc1nn(C)c2ncc(NCC3CCCCN3)cc12
InChIInChI=1S/C14H21N5/c1-10-13-7-12(9-17-14(13)19(2)18-10)16-8-11-5-3-4-6-15-11/h7,9,11,15-16H,3-6,8H2,1-2H3
InChIKeyRXVKQNQPNYYCDC-UHFFFAOYSA-N
XLogP1.83
TPSA54.77 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine?
The IUPAC name of 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine (CID 106633425) is 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine.
What is the SMILES notation for 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine?
The canonical SMILES for 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine is Cc1nn(C)c2ncc(NCC3CCCCN3)cc12.
What is the InChIKey of 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine?
The InChIKey is RXVKQNQPNYYCDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-10-13-7-12(9-17-14(13)19(2)18-10)16-8-11-5-3-4-6-15-11/h7,9,11,15-16H,3-6,8H2,1-2H3.
What are the key properties of 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine?
1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine has a molecular weight of 259.36 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-(piperidin-2-ylmethyl)pyrazolo[5,4-b]pyridin-5-amine is sourced from PubChem (CID 106633425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).