7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide

C16H12N4O4 — CID 88925808

IUPAC7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide
SMILESCOc1cc2nccc(Oc3ccc(N=O)cn3)c2cc1C(N)=O
InChIInChI=1S/C16H12N4O4/c1-23-14-7-12-10(6-11(14)16(17)21)13(4-5-18-12)24-15-3-2-9(20-22)8-19-15/h2-8H,1H3,(H2,17,21)
InChIKeyULQNRALRFHKGEM-UHFFFAOYSA-N
MW324.30 g/mol
LogP2.93
Rot. Bonds5

About 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide

7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide (PubChem CID 88925808) has the molecular formula C16H12N4O4 and a molecular weight of 324.30 g/mol. Its IUPAC name is 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide.

Molecular Properties

Compound Name7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide
PubChem CID88925808
Molecular FormulaC16H12N4O4
Molecular Weight324.30 g/mol
Exact Mass324.09
IUPAC Name7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide
SMILESCOc1cc2nccc(Oc3ccc(N=O)cn3)c2cc1C(N)=O
InChIInChI=1S/C16H12N4O4/c1-23-14-7-12-10(6-11(14)16(17)21)13(4-5-18-12)24-15-3-2-9(20-22)8-19-15/h2-8H,1H3,(H2,17,21)
InChIKeyULQNRALRFHKGEM-UHFFFAOYSA-N
XLogP2.93
TPSA116.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.30
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

7-methoxy-N-methyl-4-(4-nitrosophenoxy)quinoline-6-carboxamide
CID 88925531
4-(3-chlorophenoxy)-7-methoxyquinoline-6-carboxamide
CID 141404312
2-[4-(6-carbamoyl-7-methoxyquinolin-4-yl)oxyphenyl]acetic acid
CID 67304323
4-(3-acetamido-5-methoxyphenoxy)-7-methoxyquinoline-6-carboxamide
CID 166095714
7-methoxy-4-[3-methoxy-5-(methylcarbamoyl)phenoxy]quinoline-6-carboxamide
CID 171763786
4-[4-amino-3-(trifluoromethyl)phenoxy]-7-methoxyquinoline-6-carboxamide
CID 22936372
7-methoxy-4-(4-nitronaphthalen-1-yl)oxyquinoline-6-carboxamide
CID 169101863
4-[4-amino-3-(fluoromethyl)phenoxy]-7-methoxyquinoline-6-carboxamide
CID 89132178
4-[2-amino-4-(cyclopropylcarbamoyl)phenoxy]-7-methoxyquinoline-6-carboxamide
CID 69373218
[4-(6-carbamoyl-7-methoxyquinolin-4-yl)oxy-2-fluorophenyl]carbamic acid
CID 22936357
4-[4-[3-[4-(6-carbamoyl-7-methoxyquinolin-4-yl)oxy-2-chlorophenyl]-2-oxopropyl]-3-chlorophenoxy]-7-methylquinoline-6-carboxamide
CID 157234662
4-(4-amino-3-chloro-2-ethoxy-6-fluorophenoxy)-7-methoxyquinoline-6-carboxamide
CID 174194248

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide?
The IUPAC name of 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide (CID 88925808) is 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide.
What is the SMILES notation for 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide?
The canonical SMILES for 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide is COc1cc2nccc(Oc3ccc(N=O)cn3)c2cc1C(N)=O.
What is the InChIKey of 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide?
The InChIKey is ULQNRALRFHKGEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O4/c1-23-14-7-12-10(6-11(14)16(17)21)13(4-5-18-12)24-15-3-2-9(20-22)8-19-15/h2-8H,1H3,(H2,17,21).
What are the key properties of 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide?
7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide has a molecular weight of 324.30 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-4-[(5-nitroso-2-pyridinyl)oxy]quinoline-6-carboxamide is sourced from PubChem (CID 88925808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).