3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine

C11H19N3 — CID 139468225

IUPAC3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
SMILESCCCC(C)c1n[nH]c2c1CNCC2
InChIInChI=1S/C11H19N3/c1-3-4-8(2)11-9-7-12-6-5-10(9)13-14-11/h8,12H,3-7H2,1-2H3,(H,13,14)
InChIKeyQTVQFHWGOKXJCR-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.96
Rot. Bonds3

About 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine

3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine (PubChem CID 139468225) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
PubChem CID139468225
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
SMILESCCCC(C)c1n[nH]c2c1CNCC2
InChIInChI=1S/C11H19N3/c1-3-4-8(2)11-9-7-12-6-5-10(9)13-14-11/h8,12H,3-7H2,1-2H3,(H,13,14)
InChIKeyQTVQFHWGOKXJCR-UHFFFAOYSA-N
XLogP1.96
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-Pentyl-4,5,6,7-tetrahydro-1H-indazole
CID 585962
N-methyl-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanamine
CID 3157469
(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanamine
CID 3163200
3-methyl-1H,4H,5H,6H,7H-pyrazolo(3,4-c)pyridine
CID 71307611
3-[3-(propan-2-yl)-1H-pyrazol-5-yl]piperidine
CID 71695345
3-methyl-4,5,6,7-tetrahydro-1H-indazol-5-amine
CID 84716462
3-Isopropyl-4,5,6,7-tetrahydro-1H-indazole
CID 5226481
2-(3,5-dimethyl-1H-pyrazol-4-yl)azepane
CID 71695369
3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine
CID 82417292
3-(3-methyl-1H-pyrazol-5-yl)piperidine hydrochloride
CID 112756464
3-(piperidin-4-yl)-4,5,6,7-tetrahydro-2H-indazole hydrochloride
CID 145913453
3-(difluoromethyl)-1H,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine dihydrochloride
CID 165657638

Frequently Asked Questions

What is the IUPAC name of 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine (CID 139468225) is 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine is CCCC(C)c1n[nH]c2c1CNCC2.
What is the InChIKey of 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is QTVQFHWGOKXJCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-4-8(2)11-9-7-12-6-5-10(9)13-14-11/h8,12H,3-7H2,1-2H3,(H,13,14).
What are the key properties of 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine?
3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 193.29 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pentan-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 139468225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).