4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol

C19H23F3N4O — CID 137456802

IUPAC4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol
SMILESOC(c1n[nH]c2c1CNCC2)N1CCC(c2ccccc2C(F)(F)F)CC1
InChIInChI=1S/C19H23F3N4O/c20-19(21,22)15-4-2-1-3-13(15)12-6-9-26(10-7-12)18(27)17-14-11-23-8-5-16(14)24-25-17/h1-4,12,18,23,27H,5-11H2,(H,24,25)
InChIKeyCUYJWNIMJFXOIU-UHFFFAOYSA-N
MW380.41 g/mol
LogP2.94
Rot. Bonds3

About 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol

4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol (PubChem CID 137456802) has the molecular formula C19H23F3N4O and a molecular weight of 380.41 g/mol. Its IUPAC name is 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol.

Molecular Properties

Compound Name4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol
PubChem CID137456802
Molecular FormulaC19H23F3N4O
Molecular Weight380.41 g/mol
Exact Mass380.18
IUPAC Name4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol
SMILESOC(c1n[nH]c2c1CNCC2)N1CCC(c2ccccc2C(F)(F)F)CC1
InChIInChI=1S/C19H23F3N4O/c20-19(21,22)15-4-2-1-3-13(15)12-6-9-26(10-7-12)18(27)17-14-11-23-8-5-16(14)24-25-17/h1-4,12,18,23,27H,5-11H2,(H,24,25)
InChIKeyCUYJWNIMJFXOIU-UHFFFAOYSA-N
XLogP2.94
TPSA64.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.41
LogP ≤ 52.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol?
The IUPAC name of 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol (CID 137456802) is 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol.
What is the SMILES notation for 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol?
The canonical SMILES for 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol is OC(c1n[nH]c2c1CNCC2)N1CCC(c2ccccc2C(F)(F)F)CC1.
What is the InChIKey of 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol?
The InChIKey is CUYJWNIMJFXOIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23F3N4O/c20-19(21,22)15-4-2-1-3-13(15)12-6-9-26(10-7-12)18(27)17-14-11-23-8-5-16(14)24-25-17/h1-4,12,18,23,27H,5-11H2,(H,24,25).
What are the key properties of 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol?
4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol has a molecular weight of 380.41 g/mol, XLogP of 2.94, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanol is sourced from PubChem (CID 137456802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).