6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride

C10H8ClIN2O2 — CID 143617147

IUPAC6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride
SMILESCl.NC(=O)c1c[nH]c2ccc(I)cc2c1=O
InChIInChI=1S/C10H7IN2O2.ClH/c11-5-1-2-8-6(3-5)9(14)7(4-13-8)10(12)15;/h1-4H,(H2,12,15)(H,13,14);1H
InChIKeySLSYBGZRRWJMQP-UHFFFAOYSA-N
MW350.54 g/mol
LogP1.65
Rot. Bonds1

About 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride

6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride (PubChem CID 143617147) has the molecular formula C10H8ClIN2O2 and a molecular weight of 350.54 g/mol. Its IUPAC name is 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride
PubChem CID143617147
Molecular FormulaC10H8ClIN2O2
Molecular Weight350.54 g/mol
Exact Mass349.93
IUPAC Name6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride
SMILESCl.NC(=O)c1c[nH]c2ccc(I)cc2c1=O
InChIInChI=1S/C10H7IN2O2.ClH/c11-5-1-2-8-6(3-5)9(14)7(4-13-8)10(12)15;/h1-4H,(H2,12,15)(H,13,14);1H
InChIKeySLSYBGZRRWJMQP-UHFFFAOYSA-N
XLogP1.65
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.54
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-4-oxo-1H-quinoline-3-carboxamide
CID 601266
tert-butyl 5-iodo-1H-indole-3-carboxylate
CID 69020976
6-bromo-4-oxo-1H-quinoline-3-carbonyl chloride
CID 172682995
(5-iodo-1H-indol-3-yl)-pyrrolidin-2-ylmethanone
CID 162765620
7-[(4-chlorophenyl)-nitrosomethyl]-4-oxo-1H-quinoline-3-carboxamide
CID 57291350
7-oxo-4H-thieno[3,2-b]pyridine-6-carboxamide
CID 67551476
cyclopentyl 7-iodo-4-oxo-1H-quinoline-3-carboxylate
CID 57172194
6-acetyl-4-oxo-1H-quinoline-3-carboxylate
CID 4276311
(5-iodo-1H-indol-3-yl)-[6-(trifluoromethyl)-2-pyridinyl]methanone
CID 178155287
6-methoxy-4-oxo-1H-quinoline-3-carbohydrazide
CID 95233454
6-methoxy-4-oxo-1H-quinoline-3-carbonyl chloride
CID 172818183
4-oxo-6-(trifluoromethyl)-1H-quinoline-3-carboxylate
CID 7062046

Frequently Asked Questions

What is the IUPAC name of 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride?
The IUPAC name of 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride (CID 143617147) is 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride.
What is the SMILES notation for 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride?
The canonical SMILES for 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride is Cl.NC(=O)c1c[nH]c2ccc(I)cc2c1=O.
What is the InChIKey of 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride?
The InChIKey is SLSYBGZRRWJMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7IN2O2.ClH/c11-5-1-2-8-6(3-5)9(14)7(4-13-8)10(12)15;/h1-4H,(H2,12,15)(H,13,14);1H.
What are the key properties of 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride?
6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride has a molecular weight of 350.54 g/mol, XLogP of 1.65, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-iodo-4-oxo-1H-quinoline-3-carboxamide;hydrochloride is sourced from PubChem (CID 143617147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).