2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide

C19H17FN4O2 — CID 71938716

IUPAC2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide
SMILESCc1cccc(C(=O)Nc2ccn(C)n2)c1NC(=O)c1ccccc1F
InChIInChI=1S/C19H17FN4O2/c1-12-6-5-8-14(19(26)21-16-10-11-24(2)23-16)17(12)22-18(25)13-7-3-4-9-15(13)20/h3-11H,1-2H3,(H,22,25)(H,21,23,26)
InChIKeyPFRJSAPUEDGWCV-UHFFFAOYSA-N
MW352.37 g/mol
LogP3.37
Rot. Bonds4

About 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide

2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide (PubChem CID 71938716) has the molecular formula C19H17FN4O2 and a molecular weight of 352.37 g/mol. Its IUPAC name is 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide
PubChem CID71938716
Molecular FormulaC19H17FN4O2
Molecular Weight352.37 g/mol
Exact Mass352.13
IUPAC Name2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide
SMILESCc1cccc(C(=O)Nc2ccn(C)n2)c1NC(=O)c1ccccc1F
InChIInChI=1S/C19H17FN4O2/c1-12-6-5-8-14(19(26)21-16-10-11-24(2)23-16)17(12)22-18(25)13-7-3-4-9-15(13)20/h3-11H,1-2H3,(H,22,25)(H,21,23,26)
InChIKeyPFRJSAPUEDGWCV-UHFFFAOYSA-N
XLogP3.37
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.37
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dimethylphenyl)-2-fluorobenzamide
CID 4097270
2-fluoro-N-(2-fluoro-6-methylphenyl)benzamide
CID 115909344
2-fluoro-N-[3-methyl-1-[(1-methylpyrazol-3-yl)amino]-1-oxobutan-2-yl]benzamide
CID 51237886
2-(2-fluoroanilino)-N-(1-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 51335853
2-bromo-6-fluoro-N-(1-methylpyrazol-3-yl)benzamide
CID 115678259
2-chloro-6-fluoro-N-(1-methylpyrazol-3-yl)benzamide
CID 51228899
N-(2,6-dimethylphenyl)-1-methylpyrazole-3-carboxamide
CID 19262447
N-(3-anilinopropyl)-2-[(2-fluorobenzoyl)amino]-3-methylbenzamide
CID 86905072
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-(1-methylpyrazol-3-yl)benzamide
CID 51237893
2-[(2-fluorobenzoyl)amino]-3-methyl-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide
CID 86881850
2-(2-fluorophenyl)-N-(1-methylpyrazol-3-yl)acetamide
CID 16622031
2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide
CID 19405127

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide?
The IUPAC name of 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide (CID 71938716) is 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide.
What is the SMILES notation for 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide?
The canonical SMILES for 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide is Cc1cccc(C(=O)Nc2ccn(C)n2)c1NC(=O)c1ccccc1F.
What is the InChIKey of 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide?
The InChIKey is PFRJSAPUEDGWCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN4O2/c1-12-6-5-8-14(19(26)21-16-10-11-24(2)23-16)17(12)22-18(25)13-7-3-4-9-15(13)20/h3-11H,1-2H3,(H,22,25)(H,21,23,26).
What are the key properties of 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide?
2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide has a molecular weight of 352.37 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide is sourced from PubChem (CID 71938716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).