4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine

C10H12ClN3 — CID 119053928

IUPAC4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine
SMILESCCCc1cc(Cl)c2cnn(C)c2n1
InChIInChI=1S/C10H12ClN3/c1-3-4-7-5-9(11)8-6-12-14(2)10(8)13-7/h5-6H,3-4H2,1-2H3
InChIKeyNWEFGOBLXPGWMJ-UHFFFAOYSA-N
MW209.68 g/mol
LogP2.57
Rot. Bonds2

About 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine

4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine (PubChem CID 119053928) has the molecular formula C10H12ClN3 and a molecular weight of 209.68 g/mol. Its IUPAC name is 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine
PubChem CID119053928
Molecular FormulaC10H12ClN3
Molecular Weight209.68 g/mol
Exact Mass209.07
IUPAC Name4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine
SMILESCCCc1cc(Cl)c2cnn(C)c2n1
InChIInChI=1S/C10H12ClN3/c1-3-4-7-5-9(11)8-6-12-14(2)10(8)13-7/h5-6H,3-4H2,1-2H3
InChIKeyNWEFGOBLXPGWMJ-UHFFFAOYSA-N
XLogP2.57
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.68
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine 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

4,6-dichloro-1-methylpyrazolo[5,4-b]pyridine
CID 58083235
6-tert-butyl-4-chloro-1-methylpyrazolo[5,4-b]pyridine
CID 119053925
6-ethyl-1-methyl-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine
CID 29091132
4,6-dichloro-8-fluoro-2-propylquinoline
CID 43668690
4-chloro-6,7-dimethoxy-2-propylquinoline
CID 43668677
6-chloro-N-hexyl-1-methylpyrazolo[3,4-d]pyrimidin-4-amine
CID 82460054
N-butyl-N-[(4-chloro-1-methylpyrazolo[5,4-d]pyrimidin-6-yl)methyl]butan-1-amine
CID 63220644
10-chloro-8-propyl-3,4-dihydro-2H-[1,4]dioxepino[2,3-g]quinoline
CID 43668414
4-chloro-1-methyl-6-(pentoxymethyl)pyrazolo[5,4-d]pyrimidine
CID 63220809
6-chloro-1-methyl-4-(2-methylpropyl)pyrazolo[3,4-d]pyrimidine
CID 155413736
4-chloro-6-[(3R)-3-methoxypiperidin-1-yl]-1-methylpyrazolo[5,4-b]pyridine
CID 166284211
6-chloro-N,N,1-trimethylpyrazolo[5,4-d]pyrimidin-4-amine
CID 89181683

Frequently Asked Questions

What is the IUPAC name of 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine?
The IUPAC name of 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine (CID 119053928) is 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine.
What is the SMILES notation for 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine?
The canonical SMILES for 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine is CCCc1cc(Cl)c2cnn(C)c2n1.
What is the InChIKey of 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine?
The InChIKey is NWEFGOBLXPGWMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3/c1-3-4-7-5-9(11)8-6-12-14(2)10(8)13-7/h5-6H,3-4H2,1-2H3.
What are the key properties of 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine?
4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine has a molecular weight of 209.68 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-1-methyl-6-propylpyrazolo[3,4-b]pyridine is sourced from PubChem (CID 119053928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).