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

C9H13N3 — CID 121435497

IUPAC3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
SMILESC=C(C)c1n[nH]c2c1CNCC2
InChIInChI=1S/C9H13N3/c1-6(2)9-7-5-10-4-3-8(7)11-12-9/h10H,1,3-5H2,2H3,(H,11,12)
InChIKeyGMXJTQSRSKHKDO-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.09
Rot. Bonds1

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

3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine (PubChem CID 121435497) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
PubChem CID121435497
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
SMILESC=C(C)c1n[nH]c2c1CNCC2
InChIInChI=1S/C9H13N3/c1-6(2)9-7-5-10-4-3-8(7)11-12-9/h10H,1,3-5H2,2H3,(H,11,12)
InChIKeyGMXJTQSRSKHKDO-UHFFFAOYSA-N
XLogP1.09
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenyl-1H,4H,5H,6H,7H-pyrazolo(4,3-c)pyridine dihydrochloride
CID 67337450
N-methyl-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanamine
CID 3157469
3-(4-methylphenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 28750449
3-methyl-1H,4H,5H,6H,7H-pyrazolo(3,4-c)pyridine
CID 71307611
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
3-Cyclopropyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 29893263
3-(5-methyl-1H-pyrazol-3-yl)piperidine
CID 71695335
5-[[(3S)-1-ethylpiperidin-3-yl]methyl]-3-propan-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 99932735
3-Phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 6501606
5-Methyl-3-phenyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 13801133
4,5,6,7-tetrahydro-3-(4-piperidinyl)-2H-Indazole
CID 18187781

Frequently Asked Questions

What is the IUPAC name of 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine (CID 121435497) is 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine is C=C(C)c1n[nH]c2c1CNCC2.
What is the InChIKey of 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is GMXJTQSRSKHKDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3/c1-6(2)9-7-5-10-4-3-8(7)11-12-9/h10H,1,3-5H2,2H3,(H,11,12).
What are the key properties of 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine?
3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 163.22 g/mol, XLogP of 1.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 121435497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).