2-anilino-N-(2-cyano-3-fluorophenyl)acetamide

C15H12FN3O — CID 60862601

IUPAC2-anilino-N-(2-cyano-3-fluorophenyl)acetamide
SMILESN#Cc1c(F)cccc1NC(=O)CNc1ccccc1
InChIInChI=1S/C15H12FN3O/c16-13-7-4-8-14(12(13)9-17)19-15(20)10-18-11-5-2-1-3-6-11/h1-8,18H,10H2,(H,19,20)
InChIKeyNLVYQTCACFLMLF-UHFFFAOYSA-N
MW269.28 g/mol
LogP2.75
Rot. Bonds4

About 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide

2-anilino-N-(2-cyano-3-fluorophenyl)acetamide (PubChem CID 60862601) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-anilino-N-(2-cyano-3-fluorophenyl)acetamide
PubChem CID60862601
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name2-anilino-N-(2-cyano-3-fluorophenyl)acetamide
SMILESN#Cc1c(F)cccc1NC(=O)CNc1ccccc1
InChIInChI=1S/C15H12FN3O/c16-13-7-4-8-14(12(13)9-17)19-15(20)10-18-11-5-2-1-3-6-11/h1-8,18H,10H2,(H,19,20)
InChIKeyNLVYQTCACFLMLF-UHFFFAOYSA-N
XLogP2.75
TPSA64.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(2-cyano-3-fluorophenyl)propanamide
CID 43580751
N-(2-cyano-3-fluorophenyl)propanamide
CID 43580352
2-chloro-N-(2-cyano-3-fluorophenyl)acetamide
CID 2781266
2-amino-N-(2-cyano-3-fluorophenyl)acetamide
CID 43580746
3-chloro-N-(2-cyano-3-fluorophenyl)propanamide
CID 43580715
N-(2-cyano-3-fluorophenyl)-2-(2-hydroxyphenyl)acetamide
CID 80740497
2-[2-(2-cyano-3-fluoroanilino)-2-oxoethyl]sulfanylacetic acid
CID 2814775
N-(2-cyano-3-fluorophenyl)-2-(4-cyanophenyl)acetamide
CID 63611856
2-(3-cyano-4-fluoroanilino)-N-(2-fluorophenyl)acetamide
CID 62317346
2-anilino-N-(3-cyano-4-fluorophenyl)acetamide
CID 62316865
2-anilino-N-naphthalen-1-ylacetamide
CID 767556
N-(2-cyano-3-fluorophenyl)-2-(2-methoxyphenyl)acetamide
CID 43580433

Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide?
The IUPAC name of 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide (CID 60862601) is 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide.
What is the SMILES notation for 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide?
The canonical SMILES for 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide is N#Cc1c(F)cccc1NC(=O)CNc1ccccc1.
What is the InChIKey of 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide?
The InChIKey is NLVYQTCACFLMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c16-13-7-4-8-14(12(13)9-17)19-15(20)10-18-11-5-2-1-3-6-11/h1-8,18H,10H2,(H,19,20).
What are the key properties of 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide?
2-anilino-N-(2-cyano-3-fluorophenyl)acetamide has a molecular weight of 269.28 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(2-cyano-3-fluorophenyl)acetamide is sourced from PubChem (CID 60862601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).