7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol

C15H14N4O — CID 136867607

IUPAC7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol
SMILESCCc1cccc2c(/N=N/c3cccnc3)c(O)[nH]c12
InChIInChI=1S/C15H14N4O/c1-2-10-5-3-7-12-13(10)17-15(20)14(12)19-18-11-6-4-8-16-9-11/h3-9,17,20H,2H2,1H3/b19-18+
InChIKeyNBKDPMDPGQDWFH-VHEBQXMUSA-N
MW266.30 g/mol
LogP4.25
Rot. Bonds3

About 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol

7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol (PubChem CID 136867607) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol.

Molecular Properties

Compound Name7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol
PubChem CID136867607
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol
SMILESCCc1cccc2c(/N=N/c3cccnc3)c(O)[nH]c12
InChIInChI=1S/C15H14N4O/c1-2-10-5-3-7-12-13(10)17-15(20)14(12)19-18-11-6-4-8-16-9-11/h3-9,17,20H,2H2,1H3/b19-18+
InChIKeyNBKDPMDPGQDWFH-VHEBQXMUSA-N
XLogP4.25
TPSA73.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

3-(pyridin-3-yldiazenyl)-1H-indol-2-ol
CID 136860029
3-[(3-chlorophenyl)diazenyl]-7-methyl-1H-indol-2-ol
CID 135730473
butanedioic acid;dipyridin-3-yldiazene
CID 139196676
3-phenyldiazenyl-7-(trifluoromethyl)-1H-indol-2-ol
CID 136866763
3-[(3,5-dichlorophenyl)diazenyl]-7-methyl-1H-indol-2-ol
CID 136867574
ethyl N-[(2-hydroxy-7-methyl-1H-indol-3-yl)imino]carbamate
CID 2692659
8-ethyl-3-methyl-9H-pyrido[2,3-b]indole
CID 143620519
3-(pyridin-3-yldiazenyl)pyridine-2,4-diamine
CID 18757549
7-fluoro-3-[(4-nitrophenyl)diazenyl]-1H-indol-2-ol
CID 177249161
1-(pyridin-3-ylmethyl)-9H-carbazole
CID 66606806
(2-hydroxy-7-methyl-1H-indol-3-yl)iminourea
CID 788841
8-ethyl-2-sulfanylidene-1H-quinazolin-4-one
CID 114588827

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol?
The IUPAC name of 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol (CID 136867607) is 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol.
What is the SMILES notation for 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol?
The canonical SMILES for 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol is CCc1cccc2c(/N=N/c3cccnc3)c(O)[nH]c12.
What is the InChIKey of 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol?
The InChIKey is NBKDPMDPGQDWFH-VHEBQXMUSA-N. The full InChI is InChI=1S/C15H14N4O/c1-2-10-5-3-7-12-13(10)17-15(20)14(12)19-18-11-6-4-8-16-9-11/h3-9,17,20H,2H2,1H3/b19-18+.
What are the key properties of 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol?
7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol has a molecular weight of 266.30 g/mol, XLogP of 4.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-3-(pyridin-3-yldiazenyl)-1H-indol-2-ol is sourced from PubChem (CID 136867607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).