2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide

C16H15ClFNO2 — CID 17395083

IUPAC2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide
SMILESCCCOc1ccccc1NC(=O)c1c(F)cccc1Cl
InChIInChI=1S/C16H15ClFNO2/c1-2-10-21-14-9-4-3-8-13(14)19-16(20)15-11(17)6-5-7-12(15)18/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyOQZPDLNLSMENHT-UHFFFAOYSA-N
MW307.75 g/mol
LogP4.52
Rot. Bonds5

About 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide

2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide (PubChem CID 17395083) has the molecular formula C16H15ClFNO2 and a molecular weight of 307.75 g/mol. Its IUPAC name is 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide.

Molecular Properties

Compound Name2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide
PubChem CID17395083
Molecular FormulaC16H15ClFNO2
Molecular Weight307.75 g/mol
Exact Mass307.08
IUPAC Name2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide
SMILESCCCOc1ccccc1NC(=O)c1c(F)cccc1Cl
InChIInChI=1S/C16H15ClFNO2/c1-2-10-21-14-9-4-3-8-13(14)19-16(20)15-11(17)6-5-7-12(15)18/h3-9H,2,10H2,1H3,(H,19,20)
InChIKeyOQZPDLNLSMENHT-UHFFFAOYSA-N
XLogP4.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.75
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-chloro-6-fluorophenyl)-(2-propoxyphenyl)methanone
CID 115800741
ethyl 2-[(2-chloro-6-fluorobenzoyl)amino]benzoate
CID 2394461
2-chloro-6-fluoro-N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 26522627
4-chloro-N-(2-propoxyphenyl)pyridine-3-carboxamide
CID 81226778
2,6-dichloro-N-(2-methoxyphenyl)benzamide
CID 853872
3-fluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide
CID 115645463
methyl N-(2-propoxyphenyl)carbamate
CID 19872099
2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide
CID 17134034
2-chloro-N-(2,5-difluoro-4-methoxyphenyl)-6-fluorobenzamide
CID 122143687
2-chloro-N'-[2-(2-ethoxyphenoxy)acetyl]-6-fluorobenzohydrazide
CID 36858937
2,3-difluoro-N-(2-propoxyphenyl)pyridine-4-carboxamide
CID 105380665
[4-[[2-[(2-chloro-6-fluorobenzoyl)amino]phenyl]carbamoyl]phenyl] ethyl carbonate
CID 108931048

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide?
The IUPAC name of 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide (CID 17395083) is 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide.
What is the SMILES notation for 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide?
The canonical SMILES for 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide is CCCOc1ccccc1NC(=O)c1c(F)cccc1Cl.
What is the InChIKey of 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide?
The InChIKey is OQZPDLNLSMENHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO2/c1-2-10-21-14-9-4-3-8-13(14)19-16(20)15-11(17)6-5-7-12(15)18/h3-9H,2,10H2,1H3,(H,19,20).
What are the key properties of 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide?
2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide has a molecular weight of 307.75 g/mol, XLogP of 4.52, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluoro-N-(2-propoxyphenyl)benzamide is sourced from PubChem (CID 17395083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).