1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol

C16H20ClN3O2 — CID 155368966

IUPAC1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol
SMILESOC1(C2CCOC2)CCN(c2cc3[nH]ncc3cc2Cl)CC1
InChIInChI=1S/C16H20ClN3O2/c17-13-7-11-9-18-19-14(11)8-15(13)20-4-2-16(21,3-5-20)12-1-6-22-10-12/h7-9,12,21H,1-6,10H2,(H,18,19)
InChIKeyWIZQNBMAOWOLKB-UHFFFAOYSA-N
MW321.81 g/mol
LogP2.58
Rot. Bonds2

About 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol

1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol (PubChem CID 155368966) has the molecular formula C16H20ClN3O2 and a molecular weight of 321.81 g/mol. Its IUPAC name is 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol
PubChem CID155368966
Molecular FormulaC16H20ClN3O2
Molecular Weight321.81 g/mol
Exact Mass321.12
IUPAC Name1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol
SMILESOC1(C2CCOC2)CCN(c2cc3[nH]ncc3cc2Cl)CC1
InChIInChI=1S/C16H20ClN3O2/c17-13-7-11-9-18-19-14(11)8-15(13)20-4-2-16(21,3-5-20)12-1-6-22-10-12/h7-9,12,21H,1-6,10H2,(H,18,19)
InChIKeyWIZQNBMAOWOLKB-UHFFFAOYSA-N
XLogP2.58
TPSA61.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.81
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol?
The IUPAC name of 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol (CID 155368966) is 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol.
What is the SMILES notation for 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol?
The canonical SMILES for 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol is OC1(C2CCOC2)CCN(c2cc3[nH]ncc3cc2Cl)CC1.
What is the InChIKey of 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol?
The InChIKey is WIZQNBMAOWOLKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20ClN3O2/c17-13-7-11-9-18-19-14(11)8-15(13)20-4-2-16(21,3-5-20)12-1-6-22-10-12/h7-9,12,21H,1-6,10H2,(H,18,19).
What are the key properties of 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol?
1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol has a molecular weight of 321.81 g/mol, XLogP of 2.58, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-1H-indazol-6-yl)-4-(oxolan-3-yl)piperidin-4-ol is sourced from PubChem (CID 155368966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).