N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide

C18H20N6O — CID 74238727

IUPACN-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCNC(=O)c1n[nH]c2c1CN(Cc1cn[nH]c1-c1ccccc1)CC2
InChIInChI=1S/C18H20N6O/c1-19-18(25)17-14-11-24(8-7-15(14)21-23-17)10-13-9-20-22-16(13)12-5-3-2-4-6-12/h2-6,9H,7-8,10-11H2,1H3,(H,19,25)(H,20,22)(H,21,23)
InChIKeyMSTOGSRKKAGUCL-UHFFFAOYSA-N
MW336.40 g/mol
LogP1.72
Rot. Bonds4

About N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide

N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 74238727) has the molecular formula C18H20N6O and a molecular weight of 336.40 g/mol. Its IUPAC name is N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
PubChem CID74238727
Molecular FormulaC18H20N6O
Molecular Weight336.40 g/mol
Exact Mass336.17
IUPAC NameN-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCNC(=O)c1n[nH]c2c1CN(Cc1cn[nH]c1-c1ccccc1)CC2
InChIInChI=1S/C18H20N6O/c1-19-18(25)17-14-11-24(8-7-15(14)21-23-17)10-13-9-20-22-16(13)12-5-3-2-4-6-12/h2-6,9H,7-8,10-11H2,1H3,(H,19,25)(H,20,22)(H,21,23)
InChIKeyMSTOGSRKKAGUCL-UHFFFAOYSA-N
XLogP1.72
TPSA89.70 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 51.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide 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

N-benzyl-1-(2-hydroxyethyl)-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 28811586
4-[3-[3-(methylcarbamoyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]propoxy]benzoic acid
CID 118781481
5-[[2-[(2S)-butan-2-yl]sulfanylpyrimidin-5-yl]methyl]-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 99939772
3-N-methyl-5-N-(2-phenylpropyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3,5-dicarboxamide
CID 119073052
N-methyl-2-[(2S)-4-[(5-phenyl-1H-pyrazol-4-yl)methyl]morpholin-2-yl]quinoline-4-carboxamide
CID 92639052
1-[(5-phenyl-1H-pyrazol-4-yl)methyl]-4-propyl-1,4-diazepan-5-one
CID 42169864
4-[(3-naphthalen-1-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl)methyl]-1H-pyrazole-5-carboxylic acid
CID 56744822
5-tert-butyl-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 53015036
5-[(1-phenyl-3-pyridin-4-ylpyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 146042189
5-[2-hydroxy-3-(2-methylphenoxy)propanoyl]-N-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 118795917
5-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 46318260
formic acid;5-[(1-methyl-2-oxoquinolin-3-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 163334328

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The IUPAC name of N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide (CID 74238727) is N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The canonical SMILES for N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide is CNC(=O)c1n[nH]c2c1CN(Cc1cn[nH]c1-c1ccccc1)CC2.
What is the InChIKey of N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The InChIKey is MSTOGSRKKAGUCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N6O/c1-19-18(25)17-14-11-24(8-7-15(14)21-23-17)10-13-9-20-22-16(13)12-5-3-2-4-6-12/h2-6,9H,7-8,10-11H2,1H3,(H,19,25)(H,20,22)(H,21,23).
What are the key properties of N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 1.72, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 74238727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).