N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine

C13H14N6 — CID 2421505

IUPACN-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCN(CCc1ccccn1)c1ncnc2[nH]ncc12
InChIInChI=1S/C13H14N6/c1-19(7-5-10-4-2-3-6-14-10)13-11-8-17-18-12(11)15-9-16-13/h2-4,6,8-9H,5,7H2,1H3,(H,15,16,17,18)
InChIKeyGYPHXKWUJATJFJ-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.43
Rot. Bonds4

About N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine

N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine (PubChem CID 2421505) has the molecular formula C13H14N6 and a molecular weight of 254.30 g/mol. Its IUPAC name is N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
PubChem CID2421505
Molecular FormulaC13H14N6
Molecular Weight254.30 g/mol
Exact Mass254.13
IUPAC NameN-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
SMILESCN(CCc1ccccn1)c1ncnc2[nH]ncc12
InChIInChI=1S/C13H14N6/c1-19(7-5-10-4-2-3-6-14-10)13-11-8-17-18-12(11)15-9-16-13/h2-4,6,8-9H,5,7H2,1H3,(H,15,16,17,18)
InChIKeyGYPHXKWUJATJFJ-UHFFFAOYSA-N
XLogP1.43
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The IUPAC name of N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine (CID 2421505) is N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The canonical SMILES for N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine is CN(CCc1ccccn1)c1ncnc2[nH]ncc12.
What is the InChIKey of N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
The InChIKey is GYPHXKWUJATJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6/c1-19(7-5-10-4-2-3-6-14-10)13-11-8-17-18-12(11)15-9-16-13/h2-4,6,8-9H,5,7H2,1H3,(H,15,16,17,18).
What are the key properties of N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine?
N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine has a molecular weight of 254.30 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-pyridin-2-ylethyl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine is sourced from PubChem (CID 2421505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).