8-amino-5-formamidonaphthalene-2-sulfonic acid

C11H10N2O4S — CID 144827054

IUPAC8-amino-5-formamidonaphthalene-2-sulfonic acid
SMILESNc1ccc(NC=O)c2ccc(S(=O)(=O)O)cc12
InChIInChI=1S/C11H10N2O4S/c12-10-3-4-11(13-6-14)8-2-1-7(5-9(8)10)18(15,16)17/h1-6H,12H2,(H,13,14)(H,15,16,17)
InChIKeyXPMXNSRRJZKKQD-UHFFFAOYSA-N
MW266.28 g/mol
LogP1.24
Rot. Bonds3

About 8-amino-5-formamidonaphthalene-2-sulfonic acid

8-amino-5-formamidonaphthalene-2-sulfonic acid (PubChem CID 144827054) has the molecular formula C11H10N2O4S and a molecular weight of 266.28 g/mol. Its IUPAC name is 8-amino-5-formamidonaphthalene-2-sulfonic acid.

Molecular Properties

Compound Name8-amino-5-formamidonaphthalene-2-sulfonic acid
PubChem CID144827054
Molecular FormulaC11H10N2O4S
Molecular Weight266.28 g/mol
Exact Mass266.04
IUPAC Name8-amino-5-formamidonaphthalene-2-sulfonic acid
SMILESNc1ccc(NC=O)c2ccc(S(=O)(=O)O)cc12
InChIInChI=1S/C11H10N2O4S/c12-10-3-4-11(13-6-14)8-2-1-7(5-9(8)10)18(15,16)17/h1-6H,12H2,(H,13,14)(H,15,16,17)
InChIKeyXPMXNSRRJZKKQD-UHFFFAOYSA-N
XLogP1.24
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

5-amino-8-formamidonaphthalene-2-sulfonic acid
CID 145276006
4-formamido-3-nitrobenzenesulfonic acid
CID 168651241
3-amino-4-[2-(2-amino-4-sulfophenyl)hydrazinyl]benzenesulfonic acid
CID 2749936
5-[(2-amino-5-methylbenzoyl)amino]-8-hydroxynaphthalene-2-sulfonic acid
CID 57168080
2-(4-amino-7-sulfonaphthalen-1-yl)-3-oxo-1H-pyrazole-5-carboxylic acid
CID 54202674
CID 170845569
CID 170845569
8-amino-5-[(3-sulfophenyl)diazenyl]naphthalene-2-sulfonic acid
CID 87409528
8-[(2-amino-5-methylbenzoyl)amino]-5-hydroxynaphthalene-2-sulfonic acid
CID 57243099
3,4-diaminonaphthalene-1,7-disulfonic acid
CID 174341204
6-amino-3-[2-(4-amino-6-sulfonaphthalen-1-yl)hydrazinyl]-4-hydroxynaphthalene-2,7-disulfonic acid;4-aminobenzonitrile
CID 144827087
4-amino-3-bromobenzenesulfonic acid
CID 18398323
4-amino-3-ethenylbenzenesulfonic acid
CID 59131566

Frequently Asked Questions

What is the IUPAC name of 8-amino-5-formamidonaphthalene-2-sulfonic acid?
The IUPAC name of 8-amino-5-formamidonaphthalene-2-sulfonic acid (CID 144827054) is 8-amino-5-formamidonaphthalene-2-sulfonic acid.
What is the SMILES notation for 8-amino-5-formamidonaphthalene-2-sulfonic acid?
The canonical SMILES for 8-amino-5-formamidonaphthalene-2-sulfonic acid is Nc1ccc(NC=O)c2ccc(S(=O)(=O)O)cc12.
What is the InChIKey of 8-amino-5-formamidonaphthalene-2-sulfonic acid?
The InChIKey is XPMXNSRRJZKKQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O4S/c12-10-3-4-11(13-6-14)8-2-1-7(5-9(8)10)18(15,16)17/h1-6H,12H2,(H,13,14)(H,15,16,17).
What are the key properties of 8-amino-5-formamidonaphthalene-2-sulfonic acid?
8-amino-5-formamidonaphthalene-2-sulfonic acid has a molecular weight of 266.28 g/mol, XLogP of 1.24, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-amino-5-formamidonaphthalene-2-sulfonic acid is sourced from PubChem (CID 144827054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).