potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane

C17H23ClKN3O — CID 143840147

IUPACpotassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane
SMILESCC.CC[N-]CCNC(=O)c1cc(Cl)nc2ccc(C)cc12.[K+]
InChIInChI=1S/C15H17ClN3O.C2H6.K/c1-3-17-6-7-18-15(20)12-9-14(16)19-13-5-4-10(2)8-11(12)13;1-2;/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,20);1-2H3;/q-1;;+1
InChIKeyFFCUSCDXAGXXJV-UHFFFAOYSA-N
MW359.94 g/mol
LogP1.35
Rot. Bonds5

About potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane

potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane (PubChem CID 143840147) has the molecular formula C17H23ClKN3O and a molecular weight of 359.94 g/mol. Its IUPAC name is potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane.

Molecular Properties

Compound Namepotassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane
PubChem CID143840147
Molecular FormulaC17H23ClKN3O
Molecular Weight359.94 g/mol
Exact Mass359.12
IUPAC Namepotassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane
SMILESCC.CC[N-]CCNC(=O)c1cc(Cl)nc2ccc(C)cc12.[K+]
InChIInChI=1S/C15H17ClN3O.C2H6.K/c1-3-17-6-7-18-15(20)12-9-14(16)19-13-5-4-10(2)8-11(12)13;1-2;/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,20);1-2H3;/q-1;;+1
InChIKeyFFCUSCDXAGXXJV-UHFFFAOYSA-N
XLogP1.35
TPSA56.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.94
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-butyl-2-(2-chlorophenyl)-6-methylquinoline-4-carboxamide
CID 3625064
2-chloro-N-[2-(diethylamino)ethyl]quinoline-4-carboxamide
CID 13255244
N-butyl-2-chloroquinoline-4-carboxamide
CID 14813194
ethyl 7-[(2,6-dimethylquinoline-4-carbonyl)amino]heptanoate
CID 60521634
2-(4-methoxyphenyl)-6-methyl-N-pentylquinoline-4-carboxamide
CID 42749978
methyl 6-[(2,6-dimethylquinoline-4-carbonyl)amino]hexanoate
CID 31838218
2,6-dimethyl-N-[3-(1,2,4-triazol-4-yl)propyl]quinoline-4-carboxamide
CID 70776674
N-(2-methoxyethyl)-6-methyl-2-phenylquinoline-4-carboxamide
CID 4795719
N-hexyl-6-methyl-2-thiophen-2-ylquinoline-4-carboxamide
CID 42749781
N-(3-aminopropyl)-2-cyclopropyl-6-methylquinoline-4-carboxamide;dihydrochloride
CID 119408408
6-chloro-N-[3-(dimethylamino)propyl]-2-(4-methylphenyl)quinoline-4-carboxamide
CID 162676927
2-chloro-N-(5-hydroxypentyl)quinoline-4-carboxamide
CID 107317154

Frequently Asked Questions

What is the IUPAC name of potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane?
The IUPAC name of potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane (CID 143840147) is potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane.
What is the SMILES notation for potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane?
The canonical SMILES for potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane is CC.CC[N-]CCNC(=O)c1cc(Cl)nc2ccc(C)cc12.[K+].
What is the InChIKey of potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane?
The InChIKey is FFCUSCDXAGXXJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN3O.C2H6.K/c1-3-17-6-7-18-15(20)12-9-14(16)19-13-5-4-10(2)8-11(12)13;1-2;/h4-5,8-9H,3,6-7H2,1-2H3,(H,18,20);1-2H3;/q-1;;+1.
What are the key properties of potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane?
potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane has a molecular weight of 359.94 g/mol, XLogP of 1.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;2-[(2-chloro-6-methylquinoline-4-carbonyl)amino]ethyl-ethylazanide;ethane is sourced from PubChem (CID 143840147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).