2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide

C19H16FN3O2 — CID 86912777

IUPAC2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cnc(-c3ccccc3)nc2)cc1F
InChIInChI=1S/C19H16FN3O2/c1-25-17-8-7-13(9-16(17)20)10-18(24)23-15-11-21-19(22-12-15)14-5-3-2-4-6-14/h2-9,11-12H,10H2,1H3,(H,23,24)
InChIKeyOYAONMWNXGNKCH-UHFFFAOYSA-N
MW337.35 g/mol
LogP3.47
Rot. Bonds5

About 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide

2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide (PubChem CID 86912777) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide.

Molecular Properties

Compound Name2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide
PubChem CID86912777
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC Name2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cnc(-c3ccccc3)nc2)cc1F
InChIInChI=1S/C19H16FN3O2/c1-25-17-8-7-13(9-16(17)20)10-18(24)23-15-11-21-19(22-12-15)14-5-3-2-4-6-14/h2-9,11-12H,10H2,1H3,(H,23,24)
InChIKeyOYAONMWNXGNKCH-UHFFFAOYSA-N
XLogP3.47
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-fluoro-4-methoxyphenyl)-N-pyridin-4-ylacetamide
CID 39953694
2-(3,4-dimethoxyphenyl)-N-(6-phenyl-3-pyridinyl)acetamide
CID 110634746
3-[[2-(3-fluoro-4-methoxyphenyl)acetyl]amino]-1H-pyrazole-5-carboxylic acid
CID 64526690
2-(3-fluoro-4-methoxyphenyl)-N-(2-methylphenyl)acetamide
CID 9042833
N-[3-(2-amino-2-oxoethoxy)phenyl]-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 24649985
N-(2-benzylphenyl)-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 9045822
2-(3-fluoro-4-methoxyphenyl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 135315910
N-(2-phenylpyrimidin-5-yl)propanamide
CID 53014772
1-anilino-3-(3-fluoro-4-methoxyphenyl)propan-2-one
CID 116555256
2-(3-fluoro-4-methoxyphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 38196743
N-[4-(difluoromethoxy)phenyl]-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 9046569
N-(3-fluoro-4-methoxyphenyl)-2-(4-methoxyphenyl)acetamide
CID 110776473

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide?
The IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide (CID 86912777) is 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide.
What is the SMILES notation for 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide?
The canonical SMILES for 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide is COc1ccc(CC(=O)Nc2cnc(-c3ccccc3)nc2)cc1F.
What is the InChIKey of 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide?
The InChIKey is OYAONMWNXGNKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c1-25-17-8-7-13(9-16(17)20)10-18(24)23-15-11-21-19(22-12-15)14-5-3-2-4-6-14/h2-9,11-12H,10H2,1H3,(H,23,24).
What are the key properties of 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide?
2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide has a molecular weight of 337.35 g/mol, XLogP of 3.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-methoxyphenyl)-N-(2-phenylpyrimidin-5-yl)acetamide is sourced from PubChem (CID 86912777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).