6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide

C16H17FN4O2 — CID 133343718

IUPAC6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(N2CCOC(c3ccccc3F)C2)nn1
InChIInChI=1S/C16H17FN4O2/c1-18-16(22)13-6-7-15(20-19-13)21-8-9-23-14(10-21)11-4-2-3-5-12(11)17/h2-7,14H,8-10H2,1H3,(H,18,22)
InChIKeyOXCXLJMVMNQXTH-UHFFFAOYSA-N
MW316.34 g/mol
LogP1.55
Rot. Bonds3

About 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide

6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide (PubChem CID 133343718) has the molecular formula C16H17FN4O2 and a molecular weight of 316.34 g/mol. Its IUPAC name is 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide
PubChem CID133343718
Molecular FormulaC16H17FN4O2
Molecular Weight316.34 g/mol
Exact Mass316.13
IUPAC Name6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(N2CCOC(c3ccccc3F)C2)nn1
InChIInChI=1S/C16H17FN4O2/c1-18-16(22)13-6-7-15(20-19-13)21-8-9-23-14(10-21)11-4-2-3-5-12(11)17/h2-7,14H,8-10H2,1H3,(H,18,22)
InChIKeyOXCXLJMVMNQXTH-UHFFFAOYSA-N
XLogP1.55
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.34
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[2-(1-aminoethyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide
CID 115315974
N-methyl-6-(3-phenylpyrrolidin-1-yl)pyridazine-3-carboxamide
CID 133342994
N-(2,6-difluorophenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114612
6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyridazine-3-carboxamide
CID 133329265
N-methyl-6-(2-methylthiomorpholin-4-yl)pyridazine-3-carboxamide
CID 133329365
6-[(3aS,7aR)-1,3,3a,4,7,7a-hexahydroisoindol-2-yl]-N-methylpyridazine-3-carboxamide
CID 96566216
6-[2-(furan-2-yl)morpholin-4-yl]pyridazine-3-carboxamide
CID 133347306
6-[3-(2-amino-2-oxoethyl)piperidin-1-yl]-N-methylpyridazine-3-carboxamide
CID 133356029
2-(2-fluorophenyl)-4-(2,5,6-trimethylpyrimidin-4-yl)morpholine
CID 133363508
5-[(2S)-2-(2-fluorophenyl)morpholin-4-yl]pyrazine-2-carbonitrile
CID 124570237
N-methyl-6-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]piperidin-1-yl]pyridazine-3-carboxamide
CID 133340366
6-[(3R)-3-(2-chlorophenoxy)piperidin-1-yl]-N-methylpyridazine-3-carboxamide
CID 99857965

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide?
The IUPAC name of 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide (CID 133343718) is 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide?
The canonical SMILES for 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide is CNC(=O)c1ccc(N2CCOC(c3ccccc3F)C2)nn1.
What is the InChIKey of 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide?
The InChIKey is OXCXLJMVMNQXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN4O2/c1-18-16(22)13-6-7-15(20-19-13)21-8-9-23-14(10-21)11-4-2-3-5-12(11)17/h2-7,14H,8-10H2,1H3,(H,18,22).
What are the key properties of 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide?
6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide has a molecular weight of 316.34 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-fluorophenyl)morpholin-4-yl]-N-methylpyridazine-3-carboxamide is sourced from PubChem (CID 133343718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).