(5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol

C14H16ClFN2O — CID 134373337

IUPAC(5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol
SMILESOC(c1cc(Cl)cc2cn[nH]c12)C1(F)CCCCC1
InChIInChI=1S/C14H16ClFN2O/c15-10-6-9-8-17-18-12(9)11(7-10)13(19)14(16)4-2-1-3-5-14/h6-8,13,19H,1-5H2,(H,17,18)
InChIKeySUTNXAYIYQHGJY-UHFFFAOYSA-N
MW282.75 g/mol
LogP3.92
Rot. Bonds2

About (5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol

(5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol (PubChem CID 134373337) has the molecular formula C14H16ClFN2O and a molecular weight of 282.75 g/mol. Its IUPAC name is (5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol.

Molecular Properties

Compound Name(5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol
PubChem CID134373337
Molecular FormulaC14H16ClFN2O
Molecular Weight282.75 g/mol
Exact Mass282.09
IUPAC Name(5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol
SMILESOC(c1cc(Cl)cc2cn[nH]c12)C1(F)CCCCC1
InChIInChI=1S/C14H16ClFN2O/c15-10-6-9-8-17-18-12(9)11(7-10)13(19)14(16)4-2-1-3-5-14/h6-8,13,19H,1-5H2,(H,17,18)
InChIKeySUTNXAYIYQHGJY-UHFFFAOYSA-N
XLogP3.92
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.75
LogP ≤ 53.92
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-fluorocyclohexyl)methanol?
The IUPAC name of (5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol (CID 134373337) is (5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol.
What is the SMILES notation for (5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol?
The canonical SMILES for (5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol is OC(c1cc(Cl)cc2cn[nH]c12)C1(F)CCCCC1.
What is the InChIKey of (5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol?
The InChIKey is SUTNXAYIYQHGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClFN2O/c15-10-6-9-8-17-18-12(9)11(7-10)13(19)14(16)4-2-1-3-5-14/h6-8,13,19H,1-5H2,(H,17,18).
What are the key properties of (5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol?
(5-chloro-1H-indazol-7-yl)-(1-fluorocyclohexyl)methanol has a molecular weight of 282.75 g/mol, XLogP of 3.92, 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-fluorocyclohexyl)methanol is sourced from PubChem (CID 134373337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).