tetracene-2-carboxamide;hydrobromide

C19H14BrNO — CID 22400124

IUPACtetracene-2-carboxamide;hydrobromide
SMILESBr.NC(=O)c1ccc2cc3cc4ccccc4cc3cc2c1
InChIInChI=1S/C19H13NO.BrH/c20-19(21)15-6-5-14-9-17-7-12-3-1-2-4-13(12)8-18(17)11-16(14)10-15;/h1-11H,(H2,20,21);1H
InChIKeyORNIMIHNKOKLFT-UHFFFAOYSA-N
MW352.23 g/mol
LogP4.82
Rot. Bonds1

About tetracene-2-carboxamide;hydrobromide

tetracene-2-carboxamide;hydrobromide (PubChem CID 22400124) has the molecular formula C19H14BrNO and a molecular weight of 352.23 g/mol. Its IUPAC name is tetracene-2-carboxamide;hydrobromide.

Molecular Properties

Compound Nametetracene-2-carboxamide;hydrobromide
PubChem CID22400124
Molecular FormulaC19H14BrNO
Molecular Weight352.23 g/mol
Exact Mass351.03
IUPAC Nametetracene-2-carboxamide;hydrobromide
SMILESBr.NC(=O)c1ccc2cc3cc4ccccc4cc3cc2c1
InChIInChI=1S/C19H13NO.BrH/c20-19(21)15-6-5-14-9-17-7-12-3-1-2-4-13(12)8-18(17)11-16(14)10-15;/h1-11H,(H2,20,21);1H
InChIKeyORNIMIHNKOKLFT-UHFFFAOYSA-N
XLogP4.82
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.23
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tetracene-2-carboxamide;hydrobromide?
The IUPAC name of tetracene-2-carboxamide;hydrobromide (CID 22400124) is tetracene-2-carboxamide;hydrobromide.
What is the SMILES notation for tetracene-2-carboxamide;hydrobromide?
The canonical SMILES for tetracene-2-carboxamide;hydrobromide is Br.NC(=O)c1ccc2cc3cc4ccccc4cc3cc2c1.
What is the InChIKey of tetracene-2-carboxamide;hydrobromide?
The InChIKey is ORNIMIHNKOKLFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NO.BrH/c20-19(21)15-6-5-14-9-17-7-12-3-1-2-4-13(12)8-18(17)11-16(14)10-15;/h1-11H,(H2,20,21);1H.
What are the key properties of tetracene-2-carboxamide;hydrobromide?
tetracene-2-carboxamide;hydrobromide has a molecular weight of 352.23 g/mol, XLogP of 4.82, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tetracene-2-carboxamide;hydrobromide is sourced from PubChem (CID 22400124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).