(5-chloro-1H-indazol-7-yl)-cyclopentylmethanol

C13H15ClN2O — CID 134373345

IUPAC(5-chloro-1H-indazol-7-yl)-cyclopentylmethanol
SMILESOC(c1cc(Cl)cc2cn[nH]c12)C1CCCC1
InChIInChI=1S/C13H15ClN2O/c14-10-5-9-7-15-16-12(9)11(6-10)13(17)8-3-1-2-4-8/h5-8,13,17H,1-4H2,(H,15,16)
InChIKeyULSKDEQANAYUJR-UHFFFAOYSA-N
MW250.73 g/mol
LogP3.44
Rot. Bonds2

About (5-chloro-1H-indazol-7-yl)-cyclopentylmethanol

(5-chloro-1H-indazol-7-yl)-cyclopentylmethanol (PubChem CID 134373345) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is (5-chloro-1H-indazol-7-yl)-cyclopentylmethanol.

Molecular Properties

Compound Name(5-chloro-1H-indazol-7-yl)-cyclopentylmethanol
PubChem CID134373345
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name(5-chloro-1H-indazol-7-yl)-cyclopentylmethanol
SMILESOC(c1cc(Cl)cc2cn[nH]c12)C1CCCC1
InChIInChI=1S/C13H15ClN2O/c14-10-5-9-7-15-16-12(9)11(6-10)13(17)8-3-1-2-4-8/h5-8,13,17H,1-4H2,(H,15,16)
InChIKeyULSKDEQANAYUJR-UHFFFAOYSA-N
XLogP3.44
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 53.44
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)-cyclopentylmethanol?
The IUPAC name of (5-chloro-1H-indazol-7-yl)-cyclopentylmethanol (CID 134373345) is (5-chloro-1H-indazol-7-yl)-cyclopentylmethanol.
What is the SMILES notation for (5-chloro-1H-indazol-7-yl)-cyclopentylmethanol?
The canonical SMILES for (5-chloro-1H-indazol-7-yl)-cyclopentylmethanol is OC(c1cc(Cl)cc2cn[nH]c12)C1CCCC1.
What is the InChIKey of (5-chloro-1H-indazol-7-yl)-cyclopentylmethanol?
The InChIKey is ULSKDEQANAYUJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O/c14-10-5-9-7-15-16-12(9)11(6-10)13(17)8-3-1-2-4-8/h5-8,13,17H,1-4H2,(H,15,16).
What are the key properties of (5-chloro-1H-indazol-7-yl)-cyclopentylmethanol?
(5-chloro-1H-indazol-7-yl)-cyclopentylmethanol has a molecular weight of 250.73 g/mol, XLogP of 3.44, 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)-cyclopentylmethanol is sourced from PubChem (CID 134373345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).