N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide

C15H12N4O2 — CID 122301510

IUPACN-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide
SMILESCOc1ncc(NC(=O)c2ccc3ccccc3n2)cn1
InChIInChI=1S/C15H12N4O2/c1-21-15-16-8-11(9-17-15)18-14(20)13-7-6-10-4-2-3-5-12(10)19-13/h2-9H,1H3,(H,18,20)
InChIKeySHGNYTHWIZMUSN-UHFFFAOYSA-N
MW280.29 g/mol
LogP2.29
Rot. Bonds3

About N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide

N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide (PubChem CID 122301510) has the molecular formula C15H12N4O2 and a molecular weight of 280.29 g/mol. Its IUPAC name is N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide
PubChem CID122301510
Molecular FormulaC15H12N4O2
Molecular Weight280.29 g/mol
Exact Mass280.10
IUPAC NameN-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide
SMILESCOc1ncc(NC(=O)c2ccc3ccccc3n2)cn1
InChIInChI=1S/C15H12N4O2/c1-21-15-16-8-11(9-17-15)18-14(20)13-7-6-10-4-2-3-5-12(10)19-13/h2-9H,1H3,(H,18,20)
InChIKeySHGNYTHWIZMUSN-UHFFFAOYSA-N
XLogP2.29
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4,5-trimethoxyphenyl)quinoline-2-carboxamide
CID 17410358
N-(6-fluoro-3-pyridinyl)quinoline-2-carboxamide
CID 103789892
N-[4,5-dimethoxy-2-(quinoline-2-carbonylamino)phenyl]quinoline-2-carboxamide
CID 91594053
N-[2-(4-methylpiperidin-1-yl)pyrimidin-5-yl]quinoline-2-carboxamide
CID 122299715
N-pyridazin-4-ylquinoline-2-carboxamide
CID 175846718
N-(4-bromophenyl)quinoline-2-carboxamide
CID 5112006
N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide
CID 4789220
2-bromo-N-(2-methoxypyrimidin-5-yl)benzamide
CID 122301734
N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
CID 2111763
N-(2-methoxyethoxy)quinoline-2-carboxamide
CID 79676009
N-[4-(3-methylbutanoylamino)phenyl]quinoline-2-carboxamide
CID 33027080
N-(4-acetyl-3-methylphenyl)quinoline-2-carboxamide;methane
CID 161338496

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide?
The IUPAC name of N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide (CID 122301510) is N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide.
What is the SMILES notation for N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide?
The canonical SMILES for N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide is COc1ncc(NC(=O)c2ccc3ccccc3n2)cn1.
What is the InChIKey of N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide?
The InChIKey is SHGNYTHWIZMUSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O2/c1-21-15-16-8-11(9-17-15)18-14(20)13-7-6-10-4-2-3-5-12(10)19-13/h2-9H,1H3,(H,18,20).
What are the key properties of N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide?
N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide has a molecular weight of 280.29 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypyrimidin-5-yl)quinoline-2-carboxamide is sourced from PubChem (CID 122301510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).