N-oxotetracene-2-carboxamide

C19H11NO2 — CID 22400129

IUPACN-oxotetracene-2-carboxamide
SMILESO=NC(=O)c1ccc2cc3cc4ccccc4cc3cc2c1
InChIInChI=1S/C19H11NO2/c21-19(20-22)15-6-5-14-9-17-7-12-3-1-2-4-13(12)8-18(17)11-16(14)10-15/h1-11H
InChIKeyRHDSQCIOBQPJGR-UHFFFAOYSA-N
MW285.30 g/mol
LogP5.05
Rot. Bonds1

About N-oxotetracene-2-carboxamide

N-oxotetracene-2-carboxamide (PubChem CID 22400129) has the molecular formula C19H11NO2 and a molecular weight of 285.30 g/mol. Its IUPAC name is N-oxotetracene-2-carboxamide.

Molecular Properties

Compound NameN-oxotetracene-2-carboxamide
PubChem CID22400129
Molecular FormulaC19H11NO2
Molecular Weight285.30 g/mol
Exact Mass285.08
IUPAC NameN-oxotetracene-2-carboxamide
SMILESO=NC(=O)c1ccc2cc3cc4ccccc4cc3cc2c1
InChIInChI=1S/C19H11NO2/c21-19(20-22)15-6-5-14-9-17-7-12-3-1-2-4-13(12)8-18(17)11-16(14)10-15/h1-11H
InChIKeyRHDSQCIOBQPJGR-UHFFFAOYSA-N
XLogP5.05
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.30
LogP ≤ 55.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

anthracene-2-carbonyl azide
CID 102488485
hexacene-2-carboxylic acid
CID 87430666
anthracene-2-carboxylate
CID 11160355
tetracene-2-carboxamide;hydrobromide
CID 22400124
naphthalene-2-carbonyl isothiocyanate
CID 2113413
1-naphthalen-2-yl-2-[4-(2-naphthalen-2-yl-2-oxoacetyl)phenyl]ethane-1,2-dione
CID 10939145
dinaphthalen-2-ylmethanone
CID 10945915
naphthalene-2-carboxylic acid
CID 175967775
naphthalene-2-carboxylic acid;dihydrochloride
CID 70357946
anthracene-2,6-dicarboxylate
CID 86309851
1-(7-acetylanthracen-2-yl)ethanone
CID 139364083
(2-anthracen-2-yl-2-oxoethyl)-dimethylsulfanium
CID 58905985

Frequently Asked Questions

What is the IUPAC name of N-oxotetracene-2-carboxamide?
The IUPAC name of N-oxotetracene-2-carboxamide (CID 22400129) is N-oxotetracene-2-carboxamide.
What is the SMILES notation for N-oxotetracene-2-carboxamide?
The canonical SMILES for N-oxotetracene-2-carboxamide is O=NC(=O)c1ccc2cc3cc4ccccc4cc3cc2c1.
What is the InChIKey of N-oxotetracene-2-carboxamide?
The InChIKey is RHDSQCIOBQPJGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11NO2/c21-19(20-22)15-6-5-14-9-17-7-12-3-1-2-4-13(12)8-18(17)11-16(14)10-15/h1-11H.
What are the key properties of N-oxotetracene-2-carboxamide?
N-oxotetracene-2-carboxamide has a molecular weight of 285.30 g/mol, XLogP of 5.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-oxotetracene-2-carboxamide is sourced from PubChem (CID 22400129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).