(5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol

C12H10ClF3N2O — CID 134373379

IUPAC(5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol
SMILESOC(c1cc(Cl)cc2cn[nH]c12)C1(C(F)(F)F)CC1
InChIInChI=1S/C12H10ClF3N2O/c13-7-3-6-5-17-18-9(6)8(4-7)10(19)11(1-2-11)12(14,15)16/h3-5,10,19H,1-2H2,(H,17,18)
InChIKeyBHTZTCICTNPUQO-UHFFFAOYSA-N
MW290.67 g/mol
LogP3.59
Rot. Bonds2

About (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol

(5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol (PubChem CID 134373379) has the molecular formula C12H10ClF3N2O and a molecular weight of 290.67 g/mol. Its IUPAC name is (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name(5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol
PubChem CID134373379
Molecular FormulaC12H10ClF3N2O
Molecular Weight290.67 g/mol
Exact Mass290.04
IUPAC Name(5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol
SMILESOC(c1cc(Cl)cc2cn[nH]c12)C1(C(F)(F)F)CC1
InChIInChI=1S/C12H10ClF3N2O/c13-7-3-6-5-17-18-9(6)8(4-7)10(19)11(1-2-11)12(14,15)16/h3-5,10,19H,1-2H2,(H,17,18)
InChIKeyBHTZTCICTNPUQO-UHFFFAOYSA-N
XLogP3.59
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.67
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol?
The IUPAC name of (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol (CID 134373379) is (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol.
What is the SMILES notation for (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol?
The canonical SMILES for (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol is OC(c1cc(Cl)cc2cn[nH]c12)C1(C(F)(F)F)CC1.
What is the InChIKey of (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol?
The InChIKey is BHTZTCICTNPUQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClF3N2O/c13-7-3-6-5-17-18-9(6)8(4-7)10(19)11(1-2-11)12(14,15)16/h3-5,10,19H,1-2H2,(H,17,18).
What are the key properties of (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol?
(5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol has a molecular weight of 290.67 g/mol, XLogP of 3.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1H-indazol-7-yl)-[1-(trifluoromethyl)cyclopropyl]methanol is sourced from PubChem (CID 134373379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).