5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide

C20H18F3N5O2 — CID 155255293

IUPAC5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
SMILESO=C(NC1(C(F)(F)F)CC1)c1n[nH]c2c1CN(C(=O)c1cc3ccccn3c1)CC2
InChIInChI=1S/C20H18F3N5O2/c21-20(22,23)19(5-6-19)24-17(29)16-14-11-28(8-4-15(14)25-26-16)18(30)12-9-13-3-1-2-7-27(13)10-12/h1-3,7,9-10H,4-6,8,11H2,(H,24,29)(H,25,26)
InChIKeyLSILZKRECHLISS-UHFFFAOYSA-N
MW417.39 g/mol
LogP2.69
Rot. Bonds3

About 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide

5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 155255293) has the molecular formula C20H18F3N5O2 and a molecular weight of 417.39 g/mol. Its IUPAC name is 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
PubChem CID155255293
Molecular FormulaC20H18F3N5O2
Molecular Weight417.39 g/mol
Exact Mass417.14
IUPAC Name5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
SMILESO=C(NC1(C(F)(F)F)CC1)c1n[nH]c2c1CN(C(=O)c1cc3ccccn3c1)CC2
InChIInChI=1S/C20H18F3N5O2/c21-20(22,23)19(5-6-19)24-17(29)16-14-11-28(8-4-15(14)25-26-16)18(30)12-9-13-3-1-2-7-27(13)10-12/h1-3,7,9-10H,4-6,8,11H2,(H,24,29)(H,25,26)
InChIKeyLSILZKRECHLISS-UHFFFAOYSA-N
XLogP2.69
TPSA82.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.39
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-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

[3-(2,2-difluoromorpholine-4-carbonyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]-indolizin-2-ylmethanone
CID 155255520
N-prop-2-enyl-5-[2-(trifluoromethyl)benzoyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 42874609
5-(3-chlorobenzoyl)-N-ethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 91914428
5-benzoyl-N,N-dimethyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 110875657
5-(3,5-difluorobenzoyl)-N-(1-methylpiperidin-4-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 91914468
5-(cyclobutanecarbonyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 42877096
N-cyclohexyl-5-(1H-indole-2-carbonyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 142576774
N-cyclopropyl-5-[2-(2-fluorophenyl)acetyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 42874574
N-benzyl-5-(4-methoxybenzoyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 42873475
N-cyclopropylindolizine-2-carboxamide
CID 20974358
5-(2-fluorobenzoyl)-N-[(3-methylphenyl)methyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide
CID 42873589
[3-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]-(1H-indol-2-yl)methanone
CID 142576967

Frequently Asked Questions

What is the IUPAC name of 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The IUPAC name of 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide (CID 155255293) is 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide.
What is the SMILES notation for 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The canonical SMILES for 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide is O=C(NC1(C(F)(F)F)CC1)c1n[nH]c2c1CN(C(=O)c1cc3ccccn3c1)CC2.
What is the InChIKey of 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
The InChIKey is LSILZKRECHLISS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18F3N5O2/c21-20(22,23)19(5-6-19)24-17(29)16-14-11-28(8-4-15(14)25-26-16)18(30)12-9-13-3-1-2-7-27(13)10-12/h1-3,7,9-10H,4-6,8,11H2,(H,24,29)(H,25,26).
What are the key properties of 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide?
5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 417.39 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(indolizine-2-carbonyl)-N-[1-(trifluoromethyl)cyclopropyl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 155255293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).