1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine

C14H17N3 — CID 130214347

IUPAC1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
SMILESCc1nn(Cc2ccccc2)c2c1CCNC2
InChIInChI=1S/C14H17N3/c1-11-13-7-8-15-9-14(13)17(16-11)10-12-5-3-2-4-6-12/h2-6,15H,7-10H2,1H3
InChIKeyHQXHKFIXHMUFPV-UHFFFAOYSA-N
MW227.31 g/mol
LogP1.89
Rot. Bonds2

About 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine

1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine (PubChem CID 130214347) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine.

Molecular Properties

Compound Name1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
PubChem CID130214347
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
SMILESCc1nn(Cc2ccccc2)c2c1CCNC2
InChIInChI=1S/C14H17N3/c1-11-13-7-8-15-9-14(13)17(16-11)10-12-5-3-2-4-6-12/h2-6,15H,7-10H2,1H3
InChIKeyHQXHKFIXHMUFPV-UHFFFAOYSA-N
XLogP1.89
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine 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

3,5-Dimethyl-1-(phenylmethyl)-1H-pyrazol-4-amine
CID 206697
(1-methyl-1H-pyrazol-5-yl)(phenyl)methanamine
CID 43817898
1-benzyl-3,5-dimethyl-4-[(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)methyl]-1H-pyrazole
CID 5303281
[(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methyl](methyl)amine
CID 4961800
2-ethyl-3-phenyl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine
CID 24873261
3-phenyl-2-propan-2-yl-5,6,7,8-tetrahydro-4H-pyrazolo[3,4-d]azepine
CID 24873384
3-(4-fluorophenyl)-5-methyl-1-(2-phenylethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine
CID 44383830
1h-Pyrazolo[4,3-c]pyridine,3-(4-fluorophenyl)-4,5,6,7-tetrahydro-1-(phenylmethyl)-,hydrochloride
CID 45263015
(1S,3R)-N-((5-(3,5-difluorophenyl)-1,4-dimethyl-1H-pyrazol-3-yl)methyl)-3-fluorocyclopentanamine
CID 45273537
1-((4-Fluorophenyl)methyl)-3,5-dimethyl-1H-pyrazol-4-amine
CID 573307
3,5-dimethyl-1-(2-phenylethyl)-1H-pyrazole
CID 573288
4-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]aniline
CID 4307928

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine?
The IUPAC name of 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine (CID 130214347) is 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine.
What is the SMILES notation for 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine?
The canonical SMILES for 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine is Cc1nn(Cc2ccccc2)c2c1CCNC2.
What is the InChIKey of 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine?
The InChIKey is HQXHKFIXHMUFPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-11-13-7-8-15-9-14(13)17(16-11)10-12-5-3-2-4-6-12/h2-6,15H,7-10H2,1H3.
What are the key properties of 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine?
1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine has a molecular weight of 227.31 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine is sourced from PubChem (CID 130214347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).