2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine

C13H20N6O — CID 170366178

IUPAC2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine
SMILESCc1nc(NCCN2CCOCC2)nc2nn(C)cc12
InChIInChI=1S/C13H20N6O/c1-10-11-9-18(2)17-12(11)16-13(15-10)14-3-4-19-5-7-20-8-6-19/h9H,3-8H2,1-2H3,(H,14,16,17)
InChIKeyLZVFERPVMWYNOT-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.42
Rot. Bonds4

About 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine

2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine (PubChem CID 170366178) has the molecular formula C13H20N6O and a molecular weight of 276.34 g/mol. Its IUPAC name is 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine.

Molecular Properties

Compound Name2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine
PubChem CID170366178
Molecular FormulaC13H20N6O
Molecular Weight276.34 g/mol
Exact Mass276.17
IUPAC Name2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine
SMILESCc1nc(NCCN2CCOCC2)nc2nn(C)cc12
InChIInChI=1S/C13H20N6O/c1-10-11-9-18(2)17-12(11)16-13(15-10)14-3-4-19-5-7-20-8-6-19/h9H,3-8H2,1-2H3,(H,14,16,17)
InChIKeyLZVFERPVMWYNOT-UHFFFAOYSA-N
XLogP0.42
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-chloro-6-methyl-N-(2-morpholin-4-ylethyl)-1,3,5-triazin-2-amine
CID 143985982
4-methyl-N-(2-morpholin-4-ylethyl)-6-piperidin-1-ylpyrimidin-2-amine
CID 112909978
3-methyl-N-(2-morpholin-4-ylethyl)-1,2,4-oxadiazol-5-amine
CID 59058894
N-(3-morpholin-4-ylpropyl)-2-propylpyrazolo[3,4-d]pyrimidin-6-amine
CID 141189467
5-(4-chlorophenyl)-4-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 171989086
ethyl 4-methyl-2-(2-morpholin-4-ylethylamino)pyrimidine-5-carboxylate
CID 17121387
4-(4-ethylpiperazin-1-yl)-6-methyl-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine
CID 112913275
6-methyl-2-N-(2-morpholin-4-ylethyl)-4-N-(2,4,6-trimethylphenyl)pyrimidine-2,4-diamine
CID 112913352
2-N,2-N,6-N-trimethyl-4-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4,6-triamine
CID 80777256
6-methoxy-4-N-methyl-2-N-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80777051
(7S)-4-methyl-7-(2-methylphenyl)-2-(2-morpholin-4-ylethylamino)-7,8-dihydro-6H-quinazolin-5-one
CID 28628842
2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 112887262

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine?
The IUPAC name of 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine (CID 170366178) is 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine.
What is the SMILES notation for 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine?
The canonical SMILES for 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine is Cc1nc(NCCN2CCOCC2)nc2nn(C)cc12.
What is the InChIKey of 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine?
The InChIKey is LZVFERPVMWYNOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N6O/c1-10-11-9-18(2)17-12(11)16-13(15-10)14-3-4-19-5-7-20-8-6-19/h9H,3-8H2,1-2H3,(H,14,16,17).
What are the key properties of 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine?
2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine has a molecular weight of 276.34 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(2-morpholin-4-ylethyl)pyrazolo[3,4-d]pyrimidin-6-amine is sourced from PubChem (CID 170366178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).