2-fluoro-N-(4-propylphenyl)benzamide

C16H16FNO — CID 8803034

IUPAC2-fluoro-N-(4-propylphenyl)benzamide
SMILESCCCc1ccc(NC(=O)c2ccccc2F)cc1
InChIInChI=1S/C16H16FNO/c1-2-5-12-8-10-13(11-9-12)18-16(19)14-6-3-4-7-15(14)17/h3-4,6-11H,2,5H2,1H3,(H,18,19)
InChIKeyBKHIAWXUHJFWRX-UHFFFAOYSA-N
MW257.31 g/mol
LogP4.03
Rot. Bonds4

About 2-fluoro-N-(4-propylphenyl)benzamide

2-fluoro-N-(4-propylphenyl)benzamide (PubChem CID 8803034) has the molecular formula C16H16FNO and a molecular weight of 257.31 g/mol. Its IUPAC name is 2-fluoro-N-(4-propylphenyl)benzamide.

Molecular Properties

Compound Name2-fluoro-N-(4-propylphenyl)benzamide
PubChem CID8803034
Molecular FormulaC16H16FNO
Molecular Weight257.31 g/mol
Exact Mass257.12
IUPAC Name2-fluoro-N-(4-propylphenyl)benzamide
SMILESCCCc1ccc(NC(=O)c2ccccc2F)cc1
InChIInChI=1S/C16H16FNO/c1-2-5-12-8-10-13(11-9-12)18-16(19)14-6-3-4-7-15(14)17/h3-4,6-11H,2,5H2,1H3,(H,18,19)
InChIKeyBKHIAWXUHJFWRX-UHFFFAOYSA-N
XLogP4.03
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(diethylamino)phenyl]-2-fluorobenzamide
CID 842943
2-chloro-4,5-difluoro-N-(4-propylphenyl)benzamide
CID 26178128
N-(4-butylphenyl)-2-sulfanylbenzamide
CID 107022706
N-[4-[1-(ethylamino)propyl]phenyl]-2-fluorobenzamide
CID 170898176
2-fluoro-N-[4-[3-(4-methoxyphenyl)-2-oxopropyl]phenyl]benzamide
CID 58422785
N-[4-(2-bromoethyl)phenyl]-2,3-difluorobenzamide
CID 114310286
N-(4-butylphenyl)-2,4-difluorobenzamide
CID 8961049
N-(4-butylphenyl)-2-methylsulfanylbenzamide
CID 2228351
2-fluoro-N-[4-[(4-methylbenzoyl)amino]phenyl]benzamide
CID 577368
2-fluoro-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 17340482
3-fluoro-N-(4-propylphenyl)benzamide
CID 26178121
6-(2-fluorophenyl)-N-(4-propylphenyl)pyridine-3-carboxamide
CID 58639533

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(4-propylphenyl)benzamide?
The IUPAC name of 2-fluoro-N-(4-propylphenyl)benzamide (CID 8803034) is 2-fluoro-N-(4-propylphenyl)benzamide.
What is the SMILES notation for 2-fluoro-N-(4-propylphenyl)benzamide?
The canonical SMILES for 2-fluoro-N-(4-propylphenyl)benzamide is CCCc1ccc(NC(=O)c2ccccc2F)cc1.
What is the InChIKey of 2-fluoro-N-(4-propylphenyl)benzamide?
The InChIKey is BKHIAWXUHJFWRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO/c1-2-5-12-8-10-13(11-9-12)18-16(19)14-6-3-4-7-15(14)17/h3-4,6-11H,2,5H2,1H3,(H,18,19).
What are the key properties of 2-fluoro-N-(4-propylphenyl)benzamide?
2-fluoro-N-(4-propylphenyl)benzamide has a molecular weight of 257.31 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(4-propylphenyl)benzamide is sourced from PubChem (CID 8803034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).