2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine

C9H13N5 — CID 123578192

IUPAC2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCCc1c2c(N)ncnc2nn1CC
InChIInChI=1S/C9H13N5/c1-3-6-7-8(10)11-5-12-9(7)13-14(6)4-2/h5H,3-4H2,1-2H3,(H2,10,11,12,13)
InChIKeyQNSHYTCBQYZPAJ-UHFFFAOYSA-N
MW191.24 g/mol
LogP0.99
Rot. Bonds2

About 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine

2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine (PubChem CID 123578192) has the molecular formula C9H13N5 and a molecular weight of 191.24 g/mol. Its IUPAC name is 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine
PubChem CID123578192
Molecular FormulaC9H13N5
Molecular Weight191.24 g/mol
Exact Mass191.12
IUPAC Name2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine
SMILESCCc1c2c(N)ncnc2nn1CC
InChIInChI=1S/C9H13N5/c1-3-6-7-8(10)11-5-12-9(7)13-14(6)4-2/h5H,3-4H2,1-2H3,(H2,10,11,12,13)
InChIKeyQNSHYTCBQYZPAJ-UHFFFAOYSA-N
XLogP0.99
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.24
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine 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

3-benzyl-1-ethylpyrazolo[3,4-d]pyrimidin-4-amine
CID 159423289
3-(4-chlorophenyl)-1-ethylpyrazolo[3,4-d]pyrimidin-4-amine
CID 24866636
3-bromo-2-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine
CID 71254972
3-ethyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine
CID 57350625
5-(4-amino-1-ethylpyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzoxazol-2-amine
CID 142467589
7-ethyl-5-iodopyrrolo[2,3-d]pyrimidin-4-amine
CID 68784661
5-ethyl-1-[(2-ethyl-1,2,4-triazol-3-yl)methyl]triazol-4-amine
CID 79542440
2-[(2R)-2-aminopropyl]-3-(2-fluoro-4-phenoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 71014081
6-ethylpyrimidine-4,5-diamine
CID 55281657
4-amino-8-ethylpyrido[2,3-d]pyrimidin-5-one
CID 163553264
1-(2-ethylphenyl)-3-phenylpyrazolo[3,4-d]pyrimidin-4-amine
CID 86766176
1-ethyl-3-[3-(trifluoromethyl)phenyl]sulfanylpyrazolo[3,4-d]pyrimidin-4-amine
CID 59633722

Frequently Asked Questions

What is the IUPAC name of 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine (CID 123578192) is 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine is CCc1c2c(N)ncnc2nn1CC.
What is the InChIKey of 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine?
The InChIKey is QNSHYTCBQYZPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5/c1-3-6-7-8(10)11-5-12-9(7)13-14(6)4-2/h5H,3-4H2,1-2H3,(H2,10,11,12,13).
What are the key properties of 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine?
2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine has a molecular weight of 191.24 g/mol, XLogP of 0.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethylpyrazolo[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 123578192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).