N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide

C25H25N7O2 — CID 42170626

IUPACN-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide
SMILESCN(Cc1n[nH]c2c1CCCC2)C(=O)c1ccc(-n2cc(NC(=O)c3cccnc3)cn2)cc1
InChIInChI=1S/C25H25N7O2/c1-31(16-23-21-6-2-3-7-22(21)29-30-23)25(34)17-8-10-20(11-9-17)32-15-19(14-27-32)28-24(33)18-5-4-12-26-13-18/h4-5,8-15H,2-3,6-7,16H2,1H3,(H,28,33)(H,29,30)
InChIKeySLQLUTQYEHRRQM-UHFFFAOYSA-N
MW455.52 g/mol
LogP3.39
Rot. Bonds6

About N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide

N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide (PubChem CID 42170626) has the molecular formula C25H25N7O2 and a molecular weight of 455.52 g/mol. Its IUPAC name is N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide
PubChem CID42170626
Molecular FormulaC25H25N7O2
Molecular Weight455.52 g/mol
Exact Mass455.21
IUPAC NameN-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide
SMILESCN(Cc1n[nH]c2c1CCCC2)C(=O)c1ccc(-n2cc(NC(=O)c3cccnc3)cn2)cc1
InChIInChI=1S/C25H25N7O2/c1-31(16-23-21-6-2-3-7-22(21)29-30-23)25(34)17-8-10-20(11-9-17)32-15-19(14-27-32)28-24(33)18-5-4-12-26-13-18/h4-5,8-15H,2-3,6-7,16H2,1H3,(H,28,33)(H,29,30)
InChIKeySLQLUTQYEHRRQM-UHFFFAOYSA-N
XLogP3.39
TPSA108.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500455.52
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]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

2,4-dimethyl-N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]benzamide
CID 42276002
N-[1-[4-[1,4,5,6,7,8-hexahydrocyclohepta[d]pyrazol-3-ylmethyl(methyl)carbamoyl]phenyl]pyrazol-4-yl]oxane-4-carboxamide
CID 42362452
N-methyl-3-[4-[[2-(3-methylphenyl)acetyl]amino]pyrazol-1-yl]-N-(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)benzamide
CID 42274009
4-(3,5-dimethylpyrazol-1-yl)-N-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)benzamide
CID 70717359
N-methyl-3-pyridin-3-yl-N-(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)propanamide
CID 90650169
4-(azepan-1-ylmethyl)-N-methyl-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)benzamide
CID 135090165
N,4-dimethyl-N-(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 137339686
N-[1-[4-[3-(2-methylpyrrolidin-1-yl)propoxy]phenyl]pyrazol-4-yl]pyridine-3-carboxamide
CID 59541709
1-methyl-3-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]-1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)urea
CID 122570891
3-[2-(cyclopropylmethyl)pyrazol-3-yl]-1-(1,4,5,6,7,8-hexahydrocyclohepta[d]pyrazol-3-ylmethyl)-1-methylurea
CID 72922280
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-methyl-N-(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)benzamide
CID 26396856
N-(1-pyridin-4-ylpyrazol-4-yl)benzamide
CID 110471191

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide?
The IUPAC name of N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide (CID 42170626) is N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide is CN(Cc1n[nH]c2c1CCCC2)C(=O)c1ccc(-n2cc(NC(=O)c3cccnc3)cn2)cc1.
What is the InChIKey of N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide?
The InChIKey is SLQLUTQYEHRRQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N7O2/c1-31(16-23-21-6-2-3-7-22(21)29-30-23)25(34)17-8-10-20(11-9-17)32-15-19(14-27-32)28-24(33)18-5-4-12-26-13-18/h4-5,8-15H,2-3,6-7,16H2,1H3,(H,28,33)(H,29,30).
What are the key properties of N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide?
N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide has a molecular weight of 455.52 g/mol, XLogP of 3.39, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-[methyl(4,5,6,7-tetrahydro-1H-indazol-3-ylmethyl)carbamoyl]phenyl]pyrazol-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 42170626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).