N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine

C20H16F3N5O — CID 123894948

IUPACN-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine
SMILESFc1ccccc1Cc1nc(Nc2cccc(OCC(F)F)n2)cc2[nH]ncc12
InChIInChI=1S/C20H16F3N5O/c21-14-5-2-1-4-12(14)8-15-13-10-24-28-16(13)9-19(25-15)26-18-6-3-7-20(27-18)29-11-17(22)23/h1-7,9-10,17H,8,11H2,(H,24,28)(H,25,26,27)
InChIKeyGIZBSQQHTHNUGX-UHFFFAOYSA-N
MW399.38 g/mol
LogP4.47
Rot. Bonds7

About N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine

N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine (PubChem CID 123894948) has the molecular formula C20H16F3N5O and a molecular weight of 399.38 g/mol. Its IUPAC name is N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine.

Molecular Properties

Compound NameN-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine
PubChem CID123894948
Molecular FormulaC20H16F3N5O
Molecular Weight399.38 g/mol
Exact Mass399.13
IUPAC NameN-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine
SMILESFc1ccccc1Cc1nc(Nc2cccc(OCC(F)F)n2)cc2[nH]ncc12
InChIInChI=1S/C20H16F3N5O/c21-14-5-2-1-4-12(14)8-15-13-10-24-28-16(13)9-19(25-15)26-18-6-3-7-20(27-18)29-11-17(22)23/h1-7,9-10,17H,8,11H2,(H,24,28)(H,25,26,27)
InChIKeyGIZBSQQHTHNUGX-UHFFFAOYSA-N
XLogP4.47
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.38
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine 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

4-[(2-fluorophenyl)methyl]-N-(1-methyl-1,2,4-triazol-3-yl)-1H-pyrazolo[4,3-c]pyridin-6-amine
CID 123466176
2-[3-[[4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-yl]amino]pyrazol-1-yl]-N,N-dimethylacetamide
CID 123667405
N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-1H-pyrazole-5-carboxamide
CID 119043080
1-[6-(2,2-difluoroethoxy)-2-pyridinyl]-3-(1H-pyrazol-4-yl)urea
CID 75508141
2-N-[2-(2,2-difluoroethoxy)pyrimidin-4-yl]-4-N-[(2-fluorophenyl)methyl]-5-methanimidoylpyridine-2,4-diamine;molecular hydrogen
CID 144520039
4-[5-(2,2-difluoroethoxy)pyrazin-2-yl]-7-fluoro-1H-indazole
CID 178072806
N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-1,2,5-thiadiazole-3-carboxamide
CID 119043093
N-[(5-bromo-2-fluorophenyl)methyl]-6-ethoxypyridin-2-amine
CID 63590046
N-[6-(2,2-difluoroethoxy)-2-pyridinyl]oxane-4-carboxamide
CID 75436669
2-fluoro-6-[(1H-indazol-4-ylamino)methyl]phenol
CID 112606607
2-[(2-fluorophenyl)methyl]-4-[3-(1H-1,2,4-triazol-5-yl)phenyl]-1,3-thiazole
CID 158458323
5-[(2-fluorophenyl)methylamino]-2H-1,2,4-triazin-3-one
CID 20995217

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine?
The IUPAC name of N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine (CID 123894948) is N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine.
What is the SMILES notation for N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine?
The canonical SMILES for N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine is Fc1ccccc1Cc1nc(Nc2cccc(OCC(F)F)n2)cc2[nH]ncc12.
What is the InChIKey of N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine?
The InChIKey is GIZBSQQHTHNUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F3N5O/c21-14-5-2-1-4-12(14)8-15-13-10-24-28-16(13)9-19(25-15)26-18-6-3-7-20(27-18)29-11-17(22)23/h1-7,9-10,17H,8,11H2,(H,24,28)(H,25,26,27).
What are the key properties of N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine?
N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine has a molecular weight of 399.38 g/mol, XLogP of 4.47, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,2-difluoroethoxy)-2-pyridinyl]-4-[(2-fluorophenyl)methyl]-1H-pyrazolo[4,3-c]pyridin-6-amine is sourced from PubChem (CID 123894948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).