7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide

C15H14N4O2 — CID 155555025

IUPAC7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)Nc3nccn3C)cnc2c1
InChIInChI=1S/C15H14N4O2/c1-19-6-5-16-15(19)18-14(20)11-7-10-3-4-12(21-2)8-13(10)17-9-11/h3-9H,1-2H3,(H,16,18,20)
InChIKeyYGQWJAJXAMOLEP-UHFFFAOYSA-N
MW282.30 g/mol
LogP2.23
Rot. Bonds3

About 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide

7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide (PubChem CID 155555025) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide
PubChem CID155555025
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)Nc3nccn3C)cnc2c1
InChIInChI=1S/C15H14N4O2/c1-19-6-5-16-15(19)18-14(20)11-7-10-3-4-12(21-2)8-13(10)17-9-11/h3-9H,1-2H3,(H,16,18,20)
InChIKeyYGQWJAJXAMOLEP-UHFFFAOYSA-N
XLogP2.23
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Bay-885
CID 134128280
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3-(3-Imidazol-1-yl-propyl)-7-methoxy-3,5-dihydro-pyrimido[5,4-b]indol-4-one
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2-[5-(4-Methoxyphenyl)-1-methylimidazol-4-yl]pyridine-4-carboxylic acid
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7-methoxy-N-[(3S)-2-oxopyrrolidin-3-yl]quinoline-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide?
The IUPAC name of 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide (CID 155555025) is 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide.
What is the SMILES notation for 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide?
The canonical SMILES for 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide is COc1ccc2cc(C(=O)Nc3nccn3C)cnc2c1.
What is the InChIKey of 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide?
The InChIKey is YGQWJAJXAMOLEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-19-6-5-16-15(19)18-14(20)11-7-10-3-4-12(21-2)8-13(10)17-9-11/h3-9H,1-2H3,(H,16,18,20).
What are the key properties of 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide?
7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(1-methylimidazol-2-yl)quinoline-3-carboxamide is sourced from PubChem (CID 155555025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).