1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol

C17H18N2O — CID 155554553

IUPAC1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol
SMILESCCc1cc(C(O)Cc2ccccc2)c2cn[nH]c2c1
InChIInChI=1S/C17H18N2O/c1-2-12-8-14(15-11-18-19-16(15)9-12)17(20)10-13-6-4-3-5-7-13/h3-9,11,17,20H,2,10H2,1H3,(H,18,19)
InChIKeyBEACLDDGZYSAGK-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.40
Rot. Bonds4

About 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol

1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol (PubChem CID 155554553) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol.

Molecular Properties

Compound Name1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol
PubChem CID155554553
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol
SMILESCCc1cc(C(O)Cc2ccccc2)c2cn[nH]c2c1
InChIInChI=1S/C17H18N2O/c1-2-12-8-14(15-11-18-19-16(15)9-12)17(20)10-13-6-4-3-5-7-13/h3-9,11,17,20H,2,10H2,1H3,(H,18,19)
InChIKeyBEACLDDGZYSAGK-UHFFFAOYSA-N
XLogP3.40
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol?
The IUPAC name of 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol (CID 155554553) is 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol.
What is the SMILES notation for 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol?
The canonical SMILES for 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol is CCc1cc(C(O)Cc2ccccc2)c2cn[nH]c2c1.
What is the InChIKey of 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol?
The InChIKey is BEACLDDGZYSAGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-2-12-8-14(15-11-18-19-16(15)9-12)17(20)10-13-6-4-3-5-7-13/h3-9,11,17,20H,2,10H2,1H3,(H,18,19).
What are the key properties of 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol?
1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol has a molecular weight of 266.34 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethyl-1H-indazol-4-yl)-2-phenylethanol is sourced from PubChem (CID 155554553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).