N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide

C15H14ClFN2O — CID 62177542

IUPACN-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide
SMILESCCNc1ccccc1C(=O)Nc1ccc(Cl)c(F)c1
InChIInChI=1S/C15H14ClFN2O/c1-2-18-14-6-4-3-5-11(14)15(20)19-10-7-8-12(16)13(17)9-10/h3-9,18H,2H2,1H3,(H,19,20)
InChIKeyKRRVLWJSJCZYEC-UHFFFAOYSA-N
MW292.74 g/mol
LogP4.16
Rot. Bonds4

About N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide

N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide (PubChem CID 62177542) has the molecular formula C15H14ClFN2O and a molecular weight of 292.74 g/mol. Its IUPAC name is N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide.

Molecular Properties

Compound NameN-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide
PubChem CID62177542
Molecular FormulaC15H14ClFN2O
Molecular Weight292.74 g/mol
Exact Mass292.08
IUPAC NameN-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide
SMILESCCNc1ccccc1C(=O)Nc1ccc(Cl)c(F)c1
InChIInChI=1S/C15H14ClFN2O/c1-2-18-14-6-4-3-5-11(14)15(20)19-10-7-8-12(16)13(17)9-10/h3-9,18H,2H2,1H3,(H,19,20)
InChIKeyKRRVLWJSJCZYEC-UHFFFAOYSA-N
XLogP4.16
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.74
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,5-dichloro-4-fluorophenyl)-2-(ethylamino)benzamide
CID 107575712
N-(4-chloro-3-fluorophenyl)-2-(ethylamino)-3-fluorobenzamide
CID 62661409
N-(3-bromo-4-fluorophenyl)-2-(ethylamino)benzamide
CID 104779865
N-(4-chloro-3-fluorophenyl)-2-(propan-2-ylamino)benzamide
CID 63107936
2-(ethylamino)-N-(2-fluorophenyl)benzamide
CID 55042608
N-(4-chloro-3-fluorophenyl)-2-iodobenzamide
CID 47227907
2-bromo-N-(4-chloro-3-fluorophenyl)benzamide
CID 47227901
2-(ethylamino)-N-(4-propan-2-ylphenyl)benzamide
CID 62171900
5-bromo-N-(4-chloro-3-fluorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 63501333
2-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 9105823
N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzenesulfonamide
CID 62153791
N-(4-bromo-2-fluorophenyl)-2-(ethylamino)benzamide
CID 62171530

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide?
The IUPAC name of N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide (CID 62177542) is N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide.
What is the SMILES notation for N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide?
The canonical SMILES for N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide is CCNc1ccccc1C(=O)Nc1ccc(Cl)c(F)c1.
What is the InChIKey of N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide?
The InChIKey is KRRVLWJSJCZYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O/c1-2-18-14-6-4-3-5-11(14)15(20)19-10-7-8-12(16)13(17)9-10/h3-9,18H,2H2,1H3,(H,19,20).
What are the key properties of N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide?
N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide has a molecular weight of 292.74 g/mol, XLogP of 4.16, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-fluorophenyl)-2-(ethylamino)benzamide is sourced from PubChem (CID 62177542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).