2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol

C15H20ClN3O — CID 141302992

IUPAC2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol
SMILESOCCN1CC2=C(CN(Cc3cccc(Cl)c3)CC2)N1
InChIInChI=1S/C15H20ClN3O/c16-14-3-1-2-12(8-14)9-18-5-4-13-10-19(6-7-20)17-15(13)11-18/h1-3,8,17,20H,4-7,9-11H2
InChIKeyCZSFDNXQOGMSSD-UHFFFAOYSA-N
MW293.80 g/mol
LogP1.61
Rot. Bonds4

About 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol

2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol (PubChem CID 141302992) has the molecular formula C15H20ClN3O and a molecular weight of 293.80 g/mol. Its IUPAC name is 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol.

Molecular Properties

Compound Name2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol
PubChem CID141302992
Molecular FormulaC15H20ClN3O
Molecular Weight293.80 g/mol
Exact Mass293.13
IUPAC Name2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol
SMILESOCCN1CC2=C(CN(Cc3cccc(Cl)c3)CC2)N1
InChIInChI=1S/C15H20ClN3O/c16-14-3-1-2-12(8-14)9-18-5-4-13-10-19(6-7-20)17-15(13)11-18/h1-3,8,17,20H,4-7,9-11H2
InChIKeyCZSFDNXQOGMSSD-UHFFFAOYSA-N
XLogP1.61
TPSA38.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol 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

2-[5-[(4-chlorophenyl)methyl]-3,4,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-2-yl]ethanol
CID 141302993
2-benzyl-6-(pyridin-2-ylmethyl)-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine
CID 67376288
1-[(3-chlorophenyl)methyl]pyrrolidine
CID 12738005
1-[(3-chlorophenyl)methyl]pyrrolidine;ethane;methanol
CID 145435843
[1-[(3-chlorophenyl)methyl]piperidin-4-yl]methanol
CID 47035134
1-[(3-chlorophenyl)methyl]-4-methyl-1,4-diazepane
CID 764025
2-[(3-chlorophenyl)methyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole
CID 766064
1-(2-bromoethyl)-4-[(3-chlorophenyl)methyl]piperazine
CID 80675337
7-[(3-chlorophenyl)methyl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine
CID 69329064
6-[(3-chlorophenyl)methyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-2,4-diamine
CID 625687
1-[(3-chlorophenyl)methyl]-4-methylpiperazine;oxalic acid
CID 45156065
1-[(3-chlorophenyl)methyl]-4-[(3-fluorophenyl)methyl]piperazine
CID 3133648

Frequently Asked Questions

What is the IUPAC name of 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol?
The IUPAC name of 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol (CID 141302992) is 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol.
What is the SMILES notation for 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol?
The canonical SMILES for 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol is OCCN1CC2=C(CN(Cc3cccc(Cl)c3)CC2)N1.
What is the InChIKey of 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol?
The InChIKey is CZSFDNXQOGMSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O/c16-14-3-1-2-12(8-14)9-18-5-4-13-10-19(6-7-20)17-15(13)11-18/h1-3,8,17,20H,4-7,9-11H2.
What are the key properties of 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol?
2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol has a molecular weight of 293.80 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[(3-chlorophenyl)methyl]-3,4,5,7-tetrahydro-1H-pyrazolo[3,4-c]pyridin-2-yl]ethanol is sourced from PubChem (CID 141302992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).