8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol

C18H17N5O — CID 155329471

IUPAC8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol
SMILESNc1ccc(Nc2cc3c(cc2N)Nc2cc(O)ccc2N3)cc1
InChIInChI=1S/C18H17N5O/c19-10-1-3-11(4-2-10)21-15-9-18-17(8-13(15)20)23-16-7-12(24)5-6-14(16)22-18/h1-9,21-24H,19-20H2
InChIKeyANVPBHXBBWDSNO-UHFFFAOYSA-N
MW319.37 g/mol
LogP4.10
Rot. Bonds2

About 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol

8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol (PubChem CID 155329471) has the molecular formula C18H17N5O and a molecular weight of 319.37 g/mol. Its IUPAC name is 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol.

Molecular Properties

Compound Name8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol
PubChem CID155329471
Molecular FormulaC18H17N5O
Molecular Weight319.37 g/mol
Exact Mass319.14
IUPAC Name8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol
SMILESNc1ccc(Nc2cc3c(cc2N)Nc2cc(O)ccc2N3)cc1
InChIInChI=1S/C18H17N5O/c19-10-1-3-11(4-2-10)21-15-9-18-17(8-13(15)20)23-16-7-12(24)5-6-14(16)22-18/h1-9,21-24H,19-20H2
InChIKeyANVPBHXBBWDSNO-UHFFFAOYSA-N
XLogP4.10
TPSA108.36 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.37
LogP ≤ 54.10
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

2-N,4-N-bis(4-aminophenyl)benzene-1,2,4,5-tetramine
CID 135123549
2-(4-hydroxyanilino)benzene-1,4-diol
CID 171920009
3-amino-4-(4-methylanilino)phenol
CID 91593642
4-[2,4-diamino-5-(4-aminoanilino)anilino]benzenesulfonic acid
CID 152936105
5,10-dihydrophenazine-2,7-diamine
CID 102238341
7-chloro-2-N-[2-(methylamino)phenyl]-5,10-dihydrophenazine-2,3-diamine
CID 135139114
4-N-(4-aminophenyl)benzene-1,4-diamine
CID 10841
4-amino-2-(2,5-diamino-4-methylanilino)phenol
CID 118867539
2-N-(4-aminophenyl)-4-methylbenzene-1,2-diamine;dihydrochloride
CID 70626485
5-amino-6-(4-fluoroanilino)-1,3-dihydroindol-2-one
CID 43451771
5-amino-6-(4-propan-2-ylanilino)-1,3-dihydroindol-2-one
CID 43451744
2-(2,5-diaminoanilino)-4-hydroxybenzonitrile
CID 118867545

Frequently Asked Questions

What is the IUPAC name of 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol?
The IUPAC name of 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol (CID 155329471) is 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol.
What is the SMILES notation for 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol?
The canonical SMILES for 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol is Nc1ccc(Nc2cc3c(cc2N)Nc2cc(O)ccc2N3)cc1.
What is the InChIKey of 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol?
The InChIKey is ANVPBHXBBWDSNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O/c19-10-1-3-11(4-2-10)21-15-9-18-17(8-13(15)20)23-16-7-12(24)5-6-14(16)22-18/h1-9,21-24H,19-20H2.
What are the key properties of 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol?
8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol has a molecular weight of 319.37 g/mol, XLogP of 4.10, 2 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-7-(4-aminoanilino)-5,10-dihydrophenazin-2-ol is sourced from PubChem (CID 155329471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).