2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide

C16H23FN2O — CID 79357366

IUPAC2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
SMILESCCNc1c(F)cccc1C(=O)NC1C(C)(C)C1(C)C
InChIInChI=1S/C16H23FN2O/c1-6-18-12-10(8-7-9-11(12)17)13(20)19-14-15(2,3)16(14,4)5/h7-9,14,18H,6H2,1-5H3,(H,19,20)
InChIKeyUXQSHKJOTLWTDS-UHFFFAOYSA-N
MW278.37 g/mol
LogP3.42
Rot. Bonds4

About 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide

2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide (PubChem CID 79357366) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide.

Molecular Properties

Compound Name2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
PubChem CID79357366
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC Name2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
SMILESCCNc1c(F)cccc1C(=O)NC1C(C)(C)C1(C)C
InChIInChI=1S/C16H23FN2O/c1-6-18-12-10(8-7-9-11(12)17)13(20)19-14-15(2,3)16(14,4)5/h7-9,14,18H,6H2,1-5H3,(H,19,20)
InChIKeyUXQSHKJOTLWTDS-UHFFFAOYSA-N
XLogP3.42
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(ethylamino)-3-fluorobenzamide
CID 62648907
2-(ethylamino)-3-fluoro-N-(4-methylcyclohexyl)benzamide
CID 62650059
2-(ethylamino)-3-fluoro-N-(3-methylcyclohexyl)benzamide
CID 62661165
2-(ethylamino)-3-fluoro-N-(2,2,2-trifluoroethyl)benzamide
CID 55100188
2-fluoro-3-methyl-N-(2,2,3,3-tetramethylcyclopropyl)benzamide
CID 80711420
N-(dicyclopropylmethyl)-2-(ethylamino)-3-fluorobenzamide
CID 62662474
N-(1-amino-2-methyl-1-oxopropan-2-yl)-2-(ethylamino)-3-fluorobenzamide
CID 62660729
2-(ethylamino)-3-fluoro-N-(2-oxopiperidin-3-yl)benzamide
CID 62662588
2-(ethylamino)-3-fluoro-N-(2-phenylethyl)benzamide
CID 62648927
N-(cyclohexylmethyl)-2-(ethylamino)-3-fluorobenzamide
CID 62661338
N-cyclobutyl-3-fluoro-2-(propylamino)benzamide
CID 62662485
2-(ethylamino)-3-fluoro-N-[2-(1-methylimidazol-2-yl)ethyl]benzamide
CID 62661928

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide?
The IUPAC name of 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide (CID 79357366) is 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide.
What is the SMILES notation for 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide?
The canonical SMILES for 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide is CCNc1c(F)cccc1C(=O)NC1C(C)(C)C1(C)C.
What is the InChIKey of 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide?
The InChIKey is UXQSHKJOTLWTDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c1-6-18-12-10(8-7-9-11(12)17)13(20)19-14-15(2,3)16(14,4)5/h7-9,14,18H,6H2,1-5H3,(H,19,20).
What are the key properties of 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide?
2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide has a molecular weight of 278.37 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-3-fluoro-N-(2,2,3,3-tetramethylcyclopropyl)benzamide is sourced from PubChem (CID 79357366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).