N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine

C14H24N6 — CID 63220534

IUPACN,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine
SMILESCCC(CC)N(C)Cc1nc(NC)c2cnn(C)c2n1
InChIInChI=1S/C14H24N6/c1-6-10(7-2)19(4)9-12-17-13(15-3)11-8-16-20(5)14(11)18-12/h8,10H,6-7,9H2,1-5H3,(H,15,17,18)
InChIKeyLKRZLMPNHMXXIT-UHFFFAOYSA-N
MW276.39 g/mol
LogP2.03
Rot. Bonds6

About N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine

N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 63220534) has the molecular formula C14H24N6 and a molecular weight of 276.39 g/mol. Its IUPAC name is N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID63220534
Molecular FormulaC14H24N6
Molecular Weight276.39 g/mol
Exact Mass276.21
IUPAC NameN,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine
SMILESCCC(CC)N(C)Cc1nc(NC)c2cnn(C)c2n1
InChIInChI=1S/C14H24N6/c1-6-10(7-2)19(4)9-12-17-13(15-3)11-8-16-20(5)14(11)18-12/h8,10H,6-7,9H2,1-5H3,(H,15,17,18)
InChIKeyLKRZLMPNHMXXIT-UHFFFAOYSA-N
XLogP2.03
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.39
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N,1-dimethyl-6-[[methyl(4-methylpentan-2-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine
CID 63221485
[1-methyl-4-(methylamino)pyrazolo[3,4-d]pyrimidin-6-yl]methanol
CID 63221291
2-[[4-(ethylamino)-1-methylpyrazolo[3,4-d]pyrimidin-6-yl]methyl-methylamino]propan-1-ol
CID 104554373
N-ethyl-6-[[1-methoxypropan-2-yl(methyl)amino]methyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 63221252
6-[[1-cyclopropylethyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 63220443
N,1-dimethyl-6-[[methyl-(2-methyloxolan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine
CID 82734913
6-(2,2-difluoroethoxymethyl)-N,1-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
CID 82006493
2-[[1-methyl-4-(methylamino)pyrazolo[3,4-d]pyrimidin-6-yl]methylsulfanyl]propan-1-ol
CID 113373968
6-(1-ethoxypropan-2-yloxymethyl)-N,1-dimethylpyrazolo[3,4-d]pyrimidin-4-amine
CID 103490256
N,1-dimethyl-6-(1,2,4-triazol-1-ylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 63220908
1-[[1-methyl-4-(methylamino)pyrazolo[3,4-d]pyrimidin-6-yl]methyl]pyrrolidine-2,5-dione
CID 63220999
6-[[butyl(methyl)amino]methyl]-N-ethyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 63220569

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine (CID 63220534) is N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine is CCC(CC)N(C)Cc1nc(NC)c2cnn(C)c2n1.
What is the InChIKey of N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is LKRZLMPNHMXXIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6/c1-6-10(7-2)19(4)9-12-17-13(15-3)11-8-16-20(5)14(11)18-12/h8,10H,6-7,9H2,1-5H3,(H,15,17,18).
What are the key properties of N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine?
N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 276.39 g/mol, XLogP of 2.03, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-6-[[methyl(pentan-3-yl)amino]methyl]pyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 63220534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).