N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine

C20H21N7 — CID 70726806

IUPACN,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCc1nn(C)c2nc(-c3ccccn3)nc(N(C)CCc3ccccn3)c12
InChIInChI=1S/C20H21N7/c1-14-17-19(26(2)13-10-15-8-4-6-11-21-15)23-18(16-9-5-7-12-22-16)24-20(17)27(3)25-14/h4-9,11-12H,10,13H2,1-3H3
InChIKeyCGMMYDVKGXCLBQ-UHFFFAOYSA-N
MW359.44 g/mol
LogP2.81
Rot. Bonds5

About N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine

N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 70726806) has the molecular formula C20H21N7 and a molecular weight of 359.44 g/mol. Its IUPAC name is N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID70726806
Molecular FormulaC20H21N7
Molecular Weight359.44 g/mol
Exact Mass359.19
IUPAC NameN,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCc1nn(C)c2nc(-c3ccccn3)nc(N(C)CCc3ccccn3)c12
InChIInChI=1S/C20H21N7/c1-14-17-19(26(2)13-10-15-8-4-6-11-21-15)23-18(16-9-5-7-12-22-16)24-20(17)27(3)25-14/h4-9,11-12H,10,13H2,1-3H3
InChIKeyCGMMYDVKGXCLBQ-UHFFFAOYSA-N
XLogP2.81
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.44
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine (CID 70726806) is N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine is Cc1nn(C)c2nc(-c3ccccn3)nc(N(C)CCc3ccccn3)c12.
What is the InChIKey of N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is CGMMYDVKGXCLBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N7/c1-14-17-19(26(2)13-10-15-8-4-6-11-21-15)23-18(16-9-5-7-12-22-16)24-20(17)27(3)25-14/h4-9,11-12H,10,13H2,1-3H3.
What are the key properties of N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine?
N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 359.44 g/mol, XLogP of 2.81, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3-trimethyl-6-pyridin-2-yl-N-(2-pyridin-2-ylethyl)pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 70726806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).