(2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol

C10H10Cl2N2O — CID 131478181

IUPAC(2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol
SMILESC[C@@H](O)Cn1ncc2cc(Cl)c(Cl)cc21
InChIInChI=1S/C10H10Cl2N2O/c1-6(15)5-14-10-3-9(12)8(11)2-7(10)4-13-14/h2-4,6,15H,5H2,1H3/t6-/m1/s1
InChIKeyASFUWLSEPQDDOY-ZCFIWIBFSA-N
MW245.11 g/mol
LogP2.72
Rot. Bonds2

About (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol

(2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol (PubChem CID 131478181) has the molecular formula C10H10Cl2N2O and a molecular weight of 245.11 g/mol. Its IUPAC name is (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol.

Molecular Properties

Compound Name(2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol
PubChem CID131478181
Molecular FormulaC10H10Cl2N2O
Molecular Weight245.11 g/mol
Exact Mass244.02
IUPAC Name(2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol
SMILESC[C@@H](O)Cn1ncc2cc(Cl)c(Cl)cc21
InChIInChI=1S/C10H10Cl2N2O/c1-6(15)5-14-10-3-9(12)8(11)2-7(10)4-13-14/h2-4,6,15H,5H2,1H3/t6-/m1/s1
InChIKeyASFUWLSEPQDDOY-ZCFIWIBFSA-N
XLogP2.72
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.11
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol?
The IUPAC name of (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol (CID 131478181) is (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol.
What is the SMILES notation for (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol?
The canonical SMILES for (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol is C[C@@H](O)Cn1ncc2cc(Cl)c(Cl)cc21.
What is the InChIKey of (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol?
The InChIKey is ASFUWLSEPQDDOY-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H10Cl2N2O/c1-6(15)5-14-10-3-9(12)8(11)2-7(10)4-13-14/h2-4,6,15H,5H2,1H3/t6-/m1/s1.
What are the key properties of (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol?
(2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol has a molecular weight of 245.11 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(5,6-dichloroindazol-1-yl)propan-2-ol is sourced from PubChem (CID 131478181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).