N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide

C14H12ClFN2O — CID 55099714

IUPACN-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide
SMILESCNc1c(F)cccc1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H12ClFN2O/c1-17-13-9(5-4-7-11(13)16)14(19)18-12-8-3-2-6-10(12)15/h2-8,17H,1H3,(H,18,19)
InChIKeyNOXKCRPVTSNIOW-UHFFFAOYSA-N
MW278.71 g/mol
LogP3.77
Rot. Bonds3

About N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide

N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide (PubChem CID 55099714) has the molecular formula C14H12ClFN2O and a molecular weight of 278.71 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide
PubChem CID55099714
Molecular FormulaC14H12ClFN2O
Molecular Weight278.71 g/mol
Exact Mass278.06
IUPAC NameN-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide
SMILESCNc1c(F)cccc1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H12ClFN2O/c1-17-13-9(5-4-7-11(13)16)14(19)18-12-8-3-2-6-10(12)15/h2-8,17H,1H3,(H,18,19)
InChIKeyNOXKCRPVTSNIOW-UHFFFAOYSA-N
XLogP3.77
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.71
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-2-(methylamino)-N-(2,4,5-trifluorophenyl)benzamide
CID 62808855
N-(2,6-dichloro-3-methylphenyl)-3-fluoro-2-(methylamino)benzamide
CID 62649355
N-(3,5-difluorophenyl)-3-fluoro-2-(methylamino)benzamide
CID 62650098
N-(2-chlorophenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108500285
3-fluoro-N-(4-fluorophenyl)-2-(methylamino)benzamide
CID 62648773
N-(4-bromo-2-methylphenyl)-3-fluoro-2-(methylamino)benzamide
CID 62649691
N-(2-chlorophenyl)-N'-(2,6-difluorophenyl)propanediamide
CID 108954936
N-(2-chlorophenyl)-2-fluoro-5-methylbenzamide
CID 62509353
N-[3-chloro-2-[(S)-methylsulfinyl]phenyl]-2-fluorobenzamide
CID 95786792
2-chloro-N-(2-chlorophenyl)-3-methoxybenzamide
CID 45051392
N-(2-chlorophenyl)-2-iodobenzamide
CID 1105942
N-(2-chlorophenyl)-2-hydrazinylbenzamide
CID 62248319

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide?
The IUPAC name of N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide (CID 55099714) is N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide?
The canonical SMILES for N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide is CNc1c(F)cccc1C(=O)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide?
The InChIKey is NOXKCRPVTSNIOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClFN2O/c1-17-13-9(5-4-7-11(13)16)14(19)18-12-8-3-2-6-10(12)15/h2-8,17H,1H3,(H,18,19).
What are the key properties of N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide?
N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide has a molecular weight of 278.71 g/mol, XLogP of 3.77, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-3-fluoro-2-(methylamino)benzamide is sourced from PubChem (CID 55099714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).