N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide

C22H20FN3O4 — CID 55984704

IUPACN-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide
SMILESCOc1ccc(CC(=O)Nc2cc(F)ccc2NC(=O)c2ccccn2)c(OC)c1
InChIInChI=1S/C22H20FN3O4/c1-29-16-8-6-14(20(13-16)30-2)11-21(27)25-19-12-15(23)7-9-17(19)26-22(28)18-5-3-4-10-24-18/h3-10,12-13H,11H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyKXGYLHOWPHOGIV-UHFFFAOYSA-N
MW409.42 g/mol
LogP3.67
Rot. Bonds7

About N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide

N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide (PubChem CID 55984704) has the molecular formula C22H20FN3O4 and a molecular weight of 409.42 g/mol. Its IUPAC name is N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide
PubChem CID55984704
Molecular FormulaC22H20FN3O4
Molecular Weight409.42 g/mol
Exact Mass409.14
IUPAC NameN-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide
SMILESCOc1ccc(CC(=O)Nc2cc(F)ccc2NC(=O)c2ccccn2)c(OC)c1
InChIInChI=1S/C22H20FN3O4/c1-29-16-8-6-14(20(13-16)30-2)11-21(27)25-19-12-15(23)7-9-17(19)26-22(28)18-5-3-4-10-24-18/h3-10,12-13H,11H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyKXGYLHOWPHOGIV-UHFFFAOYSA-N
XLogP3.67
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.42
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[(5-chloro-2-methoxybenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide
CID 55834271
4-chloro-N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]phenyl]benzamide
CID 31966118
N-[4,5-dimethoxy-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 102266460
2-(2,4-dimethoxyphenyl)-N-(4-fluorophenyl)acetamide
CID 9400761
N-[4-fluoro-2-[(4-methoxy-1-phenylpyrazole-3-carbonyl)amino]phenyl]pyridine-2-carboxamide
CID 55834776
N-(4-fluoro-2-methoxyphenyl)-2-(2-methoxyphenyl)acetamide
CID 32608110
N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide
CID 55834647
N-[2-(7-aminoheptanoylamino)-4-fluorophenyl]pyridine-2-carboxamide;dihydrochloride
CID 119844812
2-(2,4-dimethoxyphenyl)-N-naphthalen-1-ylacetamide
CID 16913160
N-[4-fluoro-2-[[2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]phenyl]pyridine-2-carboxamide
CID 55984193
2-(2,4-difluorophenyl)-N-[5-methoxy-2-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 131889857
2-(2,4-dimethoxyphenyl)-N-[(4-fluorophenyl)methyl]acetamide
CID 27256771

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide?
The IUPAC name of N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide (CID 55984704) is N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide is COc1ccc(CC(=O)Nc2cc(F)ccc2NC(=O)c2ccccn2)c(OC)c1.
What is the InChIKey of N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide?
The InChIKey is KXGYLHOWPHOGIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN3O4/c1-29-16-8-6-14(20(13-16)30-2)11-21(27)25-19-12-15(23)7-9-17(19)26-22(28)18-5-3-4-10-24-18/h3-10,12-13H,11H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide?
N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide has a molecular weight of 409.42 g/mol, XLogP of 3.67, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]-4-fluorophenyl]pyridine-2-carboxamide is sourced from PubChem (CID 55984704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).