2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide

C17H14FN3O2 — CID 146019721

IUPAC2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide
SMILESCn1nccc1-c1ccc(C(N)=O)c(Oc2ccccc2F)c1
InChIInChI=1S/C17H14FN3O2/c1-21-14(8-9-20-21)11-6-7-12(17(19)22)16(10-11)23-15-5-3-2-4-13(15)18/h2-10H,1H3,(H2,19,22)
InChIKeyMFSSHRCJKRDIOL-UHFFFAOYSA-N
MW311.32 g/mol
LogP3.12
Rot. Bonds4

About 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide

2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide (PubChem CID 146019721) has the molecular formula C17H14FN3O2 and a molecular weight of 311.32 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide
PubChem CID146019721
Molecular FormulaC17H14FN3O2
Molecular Weight311.32 g/mol
Exact Mass311.11
IUPAC Name2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide
SMILESCn1nccc1-c1ccc(C(N)=O)c(Oc2ccccc2F)c1
InChIInChI=1S/C17H14FN3O2/c1-21-14(8-9-20-21)11-6-7-12(17(19)22)16(10-11)23-15-5-3-2-4-13(15)18/h2-10H,1H3,(H2,19,22)
InChIKeyMFSSHRCJKRDIOL-UHFFFAOYSA-N
XLogP3.12
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.32
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-4-(2-methylpyrazol-3-yl)benzoic acid
CID 63961568
methyl 2-fluoro-4-(2-methylpyrazol-3-yl)benzoate
CID 135274935
5-(3-fluoro-4-methoxyphenyl)-1-methylpyrazole
CID 116869104
2-fluoro-5-(2-fluorophenoxy)benzamide
CID 175987323
5-[2-(2-fluoro-4-nitrophenoxy)-5-phenylphenyl]-1-methylpyrazole
CID 58042274
5-[2-(2-fluorophenoxy)phenyl]-2-methyl-1H-pyrrole-3-carboxamide
CID 90413637
2-(4-amino-2-fluoro-5-methoxyphenoxy)benzamide
CID 107259815
3-fluoro-4-[2-(2-methylpyrazol-3-yl)-4-phenylphenoxy]benzenesulfonyl chloride
CID 58042351
4-(2-methylpyrazol-3-yl)benzene-1,2-diamine
CID 91618945
3-(2-aminoethoxy)-6-carbamoyl-2-(2-methylpyrazol-3-yl)benzoic acid
CID 91274812
5-(3,4-difluorophenyl)-1,2-dimethylpyrrole-3-carboxamide
CID 116828486
3-(2-methylpyrazol-3-yl)benzoate
CID 42556015

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide?
The IUPAC name of 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide (CID 146019721) is 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide?
The canonical SMILES for 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide is Cn1nccc1-c1ccc(C(N)=O)c(Oc2ccccc2F)c1.
What is the InChIKey of 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide?
The InChIKey is MFSSHRCJKRDIOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O2/c1-21-14(8-9-20-21)11-6-7-12(17(19)22)16(10-11)23-15-5-3-2-4-13(15)18/h2-10H,1H3,(H2,19,22).
What are the key properties of 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide?
2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide has a molecular weight of 311.32 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-4-(2-methylpyrazol-3-yl)benzamide is sourced from PubChem (CID 146019721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).