N-(2-fluorophenyl)-2-(propylamino)benzamide

C16H17FN2O — CID 62166035

IUPACN-(2-fluorophenyl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)Nc1ccccc1F
InChIInChI=1S/C16H17FN2O/c1-2-11-18-14-9-5-3-7-12(14)16(20)19-15-10-6-4-8-13(15)17/h3-10,18H,2,11H2,1H3,(H,19,20)
InChIKeyKRXVVSFUKYDVIM-UHFFFAOYSA-N
MW272.32 g/mol
LogP3.90
Rot. Bonds5

About N-(2-fluorophenyl)-2-(propylamino)benzamide

N-(2-fluorophenyl)-2-(propylamino)benzamide (PubChem CID 62166035) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-(propylamino)benzamide
PubChem CID62166035
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC NameN-(2-fluorophenyl)-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)Nc1ccccc1F
InChIInChI=1S/C16H17FN2O/c1-2-11-18-14-9-5-3-7-12(14)16(20)19-15-10-6-4-8-13(15)17/h3-10,18H,2,11H2,1H3,(H,19,20)
InChIKeyKRXVVSFUKYDVIM-UHFFFAOYSA-N
XLogP3.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(ethylamino)-N-(2-fluorophenyl)benzamide
CID 55042608
N-(4-chloro-2-methylphenyl)-2-(propylamino)benzamide
CID 63107746
N-(4-methylphenyl)-2-(propylamino)benzamide
CID 62166798
N-(3-chloro-2-methylphenyl)-2-(propylamino)benzamide
CID 62186612
N-(2-bromo-5-chlorophenyl)-2-(propylamino)benzamide
CID 81280415
3-[[2-(propylamino)benzoyl]amino]propanoic acid
CID 63107977
N-(3-hydroxypropyl)-2-(propylamino)benzamide
CID 55178627
N-(2-fluorophenyl)-6-(propylamino)pyridine-2-carboxamide
CID 62239443
2-(2-bromoethylamino)-N-propylbenzamide
CID 11066007
2-ethoxy-N-(2-fluorophenyl)benzamide
CID 773674
N-[3-oxo-3-(propylamino)propyl]-2-(propylamino)benzamide
CID 62178281
N-(3-methylphenyl)-2-(propylamino)benzamide
CID 62171242

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-(propylamino)benzamide?
The IUPAC name of N-(2-fluorophenyl)-2-(propylamino)benzamide (CID 62166035) is N-(2-fluorophenyl)-2-(propylamino)benzamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-(propylamino)benzamide?
The canonical SMILES for N-(2-fluorophenyl)-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-2-(propylamino)benzamide?
The InChIKey is KRXVVSFUKYDVIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c1-2-11-18-14-9-5-3-7-12(14)16(20)19-15-10-6-4-8-13(15)17/h3-10,18H,2,11H2,1H3,(H,19,20).
What are the key properties of N-(2-fluorophenyl)-2-(propylamino)benzamide?
N-(2-fluorophenyl)-2-(propylamino)benzamide has a molecular weight of 272.32 g/mol, XLogP of 3.90, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-(propylamino)benzamide is sourced from PubChem (CID 62166035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).