2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole

C17H15F2N3O2 — CID 175435811

IUPAC2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole
SMILESCOc1cc(-c2ccc(OC(F)F)c3nn(C4CC4)cc23)ccn1
InChIInChI=1S/C17H15F2N3O2/c1-23-15-8-10(6-7-20-15)12-4-5-14(24-17(18)19)16-13(12)9-22(21-16)11-2-3-11/h4-9,11,17H,2-3H2,1H3
InChIKeyGCJAMCFOMPWRNS-UHFFFAOYSA-N
MW331.32 g/mol
LogP4.04
Rot. Bonds5

About 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole

2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole (PubChem CID 175435811) has the molecular formula C17H15F2N3O2 and a molecular weight of 331.32 g/mol. Its IUPAC name is 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole.

Molecular Properties

Compound Name2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole
PubChem CID175435811
Molecular FormulaC17H15F2N3O2
Molecular Weight331.32 g/mol
Exact Mass331.11
IUPAC Name2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole
SMILESCOc1cc(-c2ccc(OC(F)F)c3nn(C4CC4)cc23)ccn1
InChIInChI=1S/C17H15F2N3O2/c1-23-15-8-10(6-7-20-15)12-4-5-14(24-17(18)19)16-13(12)9-22(21-16)11-2-3-11/h4-9,11,17H,2-3H2,1H3
InChIKeyGCJAMCFOMPWRNS-UHFFFAOYSA-N
XLogP4.04
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.32
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[2-Fluoro-5-(trifluoromethyl)phenyl]-7-methoxy-1-(pyrazin-2-ylmethyl)indazole
CID 134611931
(5-Methoxy-indol-1-yl)-propyl-pyridin-4-yl-amine
CID 10731528
8-Methoxy-2-[4-(1-methyl-4-pyridin-4-yl-1H-pyrazol-3-yl)-phenoxymethyl]-quinoline
CID 11517420
4-(3-methoxypyridin-4-yl)-6-(trifluoromethyl)-1H-indazole
CID 89783137
5-[4-(Trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyridine
CID 127044563
5-[4-(Trifluoromethoxy)phenyl]-3-(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 127044564
3-(4-methoxy-2-methylphenyl)-4-(3-methoxyphenyl)-1H-pyrazolo[4,3-c]pyridine
CID 155569693
1-(2-methoxyphenyl)-3-phenyl-7-(trifluoromethyl)-1H-pyrazolo[4,3-c]quinoline
CID 15990620
3-Methyl-1-o-tolyl-6-trifluoromethoxy-1H-pyrrolo[3,2-c]quinoline
CID 9798780
2-Cyclopropyl-7-(difluoromethoxy)-4-(3,4,5-trimethoxyphenyl)indazole
CID 172638504
4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-N-(2-methylpropyl)pyridine-2-carboxamide
CID 175435808
N-benzyl-4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]pyridine-2-carboxamide
CID 175435809

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole?
The IUPAC name of 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole (CID 175435811) is 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole.
What is the SMILES notation for 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole?
The canonical SMILES for 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole is COc1cc(-c2ccc(OC(F)F)c3nn(C4CC4)cc23)ccn1.
What is the InChIKey of 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole?
The InChIKey is GCJAMCFOMPWRNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F2N3O2/c1-23-15-8-10(6-7-20-15)12-4-5-14(24-17(18)19)16-13(12)9-22(21-16)11-2-3-11/h4-9,11,17H,2-3H2,1H3.
What are the key properties of 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole?
2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole has a molecular weight of 331.32 g/mol, XLogP of 4.04, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-7-(difluoromethoxy)-4-(2-methoxy-4-pyridinyl)indazole is sourced from PubChem (CID 175435811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).