4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine

C20H20F2N4O2 — CID 175435810

IUPAC4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine
SMILESFC(F)Oc1ccc(-c2ccnc(N3CCOCC3)c2)c2cn(C3CC3)nc12
InChIInChI=1S/C20H20F2N4O2/c21-20(22)28-17-4-3-15(16-12-26(14-1-2-14)24-19(16)17)13-5-6-23-18(11-13)25-7-9-27-10-8-25/h3-6,11-12,14,20H,1-2,7-10H2
InChIKeyOVRWSYKMWZUZEB-UHFFFAOYSA-N
MW386.40 g/mol
LogP3.87
Rot. Bonds5

About 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine

4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine (PubChem CID 175435810) has the molecular formula C20H20F2N4O2 and a molecular weight of 386.40 g/mol. Its IUPAC name is 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine
PubChem CID175435810
Molecular FormulaC20H20F2N4O2
Molecular Weight386.40 g/mol
Exact Mass386.16
IUPAC Name4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine
SMILESFC(F)Oc1ccc(-c2ccnc(N3CCOCC3)c2)c2cn(C3CC3)nc12
InChIInChI=1S/C20H20F2N4O2/c21-20(22)28-17-4-3-15(16-12-26(14-1-2-14)24-19(16)17)13-5-6-23-18(11-13)25-7-9-27-10-8-25/h3-6,11-12,14,20H,1-2,7-10H2
InChIKeyOVRWSYKMWZUZEB-UHFFFAOYSA-N
XLogP3.87
TPSA52.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.40
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine?
The IUPAC name of 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine (CID 175435810) is 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine?
The canonical SMILES for 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine is FC(F)Oc1ccc(-c2ccnc(N3CCOCC3)c2)c2cn(C3CC3)nc12.
What is the InChIKey of 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine?
The InChIKey is OVRWSYKMWZUZEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F2N4O2/c21-20(22)28-17-4-3-15(16-12-26(14-1-2-14)24-19(16)17)13-5-6-23-18(11-13)25-7-9-27-10-8-25/h3-6,11-12,14,20H,1-2,7-10H2.
What are the key properties of 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine?
4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine has a molecular weight of 386.40 g/mol, XLogP of 3.87, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[2-cyclopropyl-7-(difluoromethoxy)indazol-4-yl]-2-pyridinyl]morpholine is sourced from PubChem (CID 175435810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).