2-(4-indazol-1-ylphenoxy)ethanamine

C15H15N3O — CID 82513930

IUPAC2-(4-indazol-1-ylphenoxy)ethanamine
SMILESNCCOc1ccc(-n2ncc3ccccc32)cc1
InChIInChI=1S/C15H15N3O/c16-9-10-19-14-7-5-13(6-8-14)18-15-4-2-1-3-12(15)11-17-18/h1-8,11H,9-10,16H2
InChIKeySJEYTSILWFKGMF-UHFFFAOYSA-N
MW253.30 g/mol
LogP2.36
Rot. Bonds4

About 2-(4-indazol-1-ylphenoxy)ethanamine

2-(4-indazol-1-ylphenoxy)ethanamine (PubChem CID 82513930) has the molecular formula C15H15N3O and a molecular weight of 253.30 g/mol. Its IUPAC name is 2-(4-indazol-1-ylphenoxy)ethanamine.

Molecular Properties

Compound Name2-(4-indazol-1-ylphenoxy)ethanamine
PubChem CID82513930
Molecular FormulaC15H15N3O
Molecular Weight253.30 g/mol
Exact Mass253.12
IUPAC Name2-(4-indazol-1-ylphenoxy)ethanamine
SMILESNCCOc1ccc(-n2ncc3ccccc32)cc1
InChIInChI=1S/C15H15N3O/c16-9-10-19-14-7-5-13(6-8-14)18-15-4-2-1-3-12(15)11-17-18/h1-8,11H,9-10,16H2
InChIKeySJEYTSILWFKGMF-UHFFFAOYSA-N
XLogP2.36
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-naphthalen-2-ylindazole
CID 134338014
2-[4-(2-indazol-1-ylethoxy)phenyl]ethanamine
CID 62139987
2-(1-methylindazol-6-yl)oxyethanamine
CID 84663334
2-(3-indazol-1-ylphenyl)ethanamine
CID 63942339
[4-(3-indazol-1-ylpropoxy)phenyl]methanamine
CID 62140171
(4-indazol-1-yl-2-methylphenyl)methanamine
CID 55038931
2-(2-indazol-1-ylethoxy)ethanamine
CID 103482335
2-[4-(2-aminoethoxy)phenoxy]ethanamine;dihydrochloride
CID 46786149
2-[4-(5-methyltetrazol-1-yl)phenoxy]ethanamine
CID 82512738
1-(5-indazol-1-yl-2-pyridinyl)propan-1-ol
CID 112585519
1-(6-butan-2-yl-3-pyridinyl)indazole
CID 175620013
1-[1-(4-tert-butylphenoxy)propan-2-yl]-3-(4-indazol-1-ylphenyl)urea
CID 146148443

Frequently Asked Questions

What is the IUPAC name of 2-(4-indazol-1-ylphenoxy)ethanamine?
The IUPAC name of 2-(4-indazol-1-ylphenoxy)ethanamine (CID 82513930) is 2-(4-indazol-1-ylphenoxy)ethanamine.
What is the SMILES notation for 2-(4-indazol-1-ylphenoxy)ethanamine?
The canonical SMILES for 2-(4-indazol-1-ylphenoxy)ethanamine is NCCOc1ccc(-n2ncc3ccccc32)cc1.
What is the InChIKey of 2-(4-indazol-1-ylphenoxy)ethanamine?
The InChIKey is SJEYTSILWFKGMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c16-9-10-19-14-7-5-13(6-8-14)18-15-4-2-1-3-12(15)11-17-18/h1-8,11H,9-10,16H2.
What are the key properties of 2-(4-indazol-1-ylphenoxy)ethanamine?
2-(4-indazol-1-ylphenoxy)ethanamine has a molecular weight of 253.30 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-indazol-1-ylphenoxy)ethanamine is sourced from PubChem (CID 82513930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).