1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine

C10H14N6O — CID 175908437

IUPAC1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine
SMILESNc1nc(N)c2cnn(CC3CCCO3)c2n1
InChIInChI=1S/C10H14N6O/c11-8-7-4-13-16(5-6-2-1-3-17-6)9(7)15-10(12)14-8/h4,6H,1-3,5H2,(H4,11,12,14,15)
InChIKeyOOZLVVOJCKMHQC-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.17
Rot. Bonds2

About 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine

1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine (PubChem CID 175908437) has the molecular formula C10H14N6O and a molecular weight of 234.26 g/mol. Its IUPAC name is 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine.

Molecular Properties

Compound Name1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine
PubChem CID175908437
Molecular FormulaC10H14N6O
Molecular Weight234.26 g/mol
Exact Mass234.12
IUPAC Name1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine
SMILESNc1nc(N)c2cnn(CC3CCCO3)c2n1
InChIInChI=1S/C10H14N6O/c11-8-7-4-13-16(5-6-2-1-3-17-6)9(7)15-10(12)14-8/h4,6H,1-3,5H2,(H4,11,12,14,15)
InChIKeyOOZLVVOJCKMHQC-UHFFFAOYSA-N
XLogP0.17
TPSA104.87 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-1-[[(2R)-oxolan-2-yl]methyl]pyrazolo[3,4-b]pyrazine
CID 168751993
5-bromo-1-(oxolan-2-ylmethyl)pyrazol-4-ol
CID 117232249
N,N-dimethyl-2-(oxolan-2-ylmethyl)pyrazol-3-amine
CID 142163207
5-methyl-1-[[(2R)-oxolan-2-yl]methyl]pyrazol-3-amine
CID 165471860
4-[1-(oxolan-2-ylmethyl)pyrazol-4-yl]aniline
CID 63328036
3,5-diethyl-1-(oxolan-2-ylmethyl)pyrazol-4-amine
CID 82702523
6-(oxolan-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 112681350
6-[[1-(oxolan-2-ylmethyl)tetrazol-5-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine
CID 24523086
5-(oxolan-2-ylmethyl)-1,2,4-thiadiazol-3-amine
CID 65159398
5-(cyclobutylamino)-2-(oxolan-2-ylmethyl)pyridazin-3-one
CID 103220570
5-methyl-3-(oxan-2-ylmethyl)triazolo[4,5-d]pyrimidin-7-amine
CID 70695147
2,5,6-trimethyl-7-(oxolan-2-ylmethyl)pyrrolo[2,3-d]pyrimidin-4-amine
CID 43337004

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine?
The IUPAC name of 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine (CID 175908437) is 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine.
What is the SMILES notation for 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine?
The canonical SMILES for 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine is Nc1nc(N)c2cnn(CC3CCCO3)c2n1.
What is the InChIKey of 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine?
The InChIKey is OOZLVVOJCKMHQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N6O/c11-8-7-4-13-16(5-6-2-1-3-17-6)9(7)15-10(12)14-8/h4,6H,1-3,5H2,(H4,11,12,14,15).
What are the key properties of 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine?
1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine has a molecular weight of 234.26 g/mol, XLogP of 0.17, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-ylmethyl)pyrazolo[3,4-d]pyrimidine-4,6-diamine is sourced from PubChem (CID 175908437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).