4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine

C9H10ClN3 — CID 76847159

IUPAC4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine
SMILESCC(C)c1[nH]nc2ccnc(Cl)c12
InChIInChI=1S/C9H10ClN3/c1-5(2)8-7-6(12-13-8)3-4-11-9(7)10/h3-5H,1-2H3,(H,12,13)
InChIKeyYAYNGDQEUOQIHG-UHFFFAOYSA-N
MW195.65 g/mol
LogP2.73
Rot. Bonds1

About 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine

4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine (PubChem CID 76847159) has the molecular formula C9H10ClN3 and a molecular weight of 195.65 g/mol. Its IUPAC name is 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine
PubChem CID76847159
Molecular FormulaC9H10ClN3
Molecular Weight195.65 g/mol
Exact Mass195.06
IUPAC Name4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine
SMILESCC(C)c1[nH]nc2ccnc(Cl)c12
InChIInChI=1S/C9H10ClN3/c1-5(2)8-7-6(12-13-8)3-4-11-9(7)10/h3-5H,1-2H3,(H,12,13)
InChIKeyYAYNGDQEUOQIHG-UHFFFAOYSA-N
XLogP2.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

3-pyridin-4-yl-1H-indazole
CID 12412578
3-(1H-pyrazol-5-yl)pyridine
CID 7074967
N-(4-pyridinyl)-1H-indol-1-amine
CID 3081186
3-Methyl-5-(Pyridin-3-Yl)-2h-Pyrazolo[3,4-C]pyridine
CID 71254055
N-(5,6-dichloro-3-pyridinyl)-1-(1H-indazol-5-yl)methanimine
CID 77844771
3-(6-chloropyridazin-3-yl)-1H-indole
CID 2763611
2-methyl-5-(1H-pyrazol-5-yl)pyridine
CID 2805912
3-(5-Methyl-1H-pyrazol-3-yl)pyridine
CID 12707229
4-(3-(3-chlorophenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrazol-4-yl)pyridine
CID 22037400
4-(3-(4-chlorophenyl)-5-(1-methylpiperidin-4-yl)-1H-pyrazol-4-yl)pyridine
CID 22037512
3-(Pyridin-4-ylethynyl)-1H-indazole
CID 42606077
3-methyl-5-(pyridin-3-yl)-1H-indazole
CID 49830586

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine (CID 76847159) is 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine is CC(C)c1[nH]nc2ccnc(Cl)c12.
What is the InChIKey of 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine?
The InChIKey is YAYNGDQEUOQIHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3/c1-5(2)8-7-6(12-13-8)3-4-11-9(7)10/h3-5H,1-2H3,(H,12,13).
What are the key properties of 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine?
4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine has a molecular weight of 195.65 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-propan-2-yl-2H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 76847159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).