5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide

C16H16ClFN2O — CID 62173586

IUPAC5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide
SMILESCCNc1ccc(Cl)cc1C(=O)N(C)c1cccc(F)c1
InChIInChI=1S/C16H16ClFN2O/c1-3-19-15-8-7-11(17)9-14(15)16(21)20(2)13-6-4-5-12(18)10-13/h4-10,19H,3H2,1-2H3
InChIKeyRJBIHYILUCTFGP-UHFFFAOYSA-N
MW306.77 g/mol
LogP4.19
Rot. Bonds4

About 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide

5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide (PubChem CID 62173586) has the molecular formula C16H16ClFN2O and a molecular weight of 306.77 g/mol. Its IUPAC name is 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide.

Molecular Properties

Compound Name5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide
PubChem CID62173586
Molecular FormulaC16H16ClFN2O
Molecular Weight306.77 g/mol
Exact Mass306.09
IUPAC Name5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide
SMILESCCNc1ccc(Cl)cc1C(=O)N(C)c1cccc(F)c1
InChIInChI=1S/C16H16ClFN2O/c1-3-19-15-8-7-11(17)9-14(15)16(21)20(2)13-6-4-5-12(18)10-13/h4-10,19H,3H2,1-2H3
InChIKeyRJBIHYILUCTFGP-UHFFFAOYSA-N
XLogP4.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-ethyl-2-(ethylamino)-N-methylbenzamide
CID 62169124
5-chloro-N-ethyl-N-(3-fluorophenyl)-2-(methylamino)benzamide
CID 62179424
5-chloro-2-(ethylamino)-N-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 62180211
5-chloro-N-methyl-2-(methylamino)-N-phenylbenzamide
CID 55042648
5-chloro-N-(2,4-difluorophenyl)-2-(ethylamino)benzamide
CID 62166930
5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide
CID 62165442
5-chloro-N-(2-chloro-4-fluorophenyl)-2-(ethylamino)benzamide
CID 62166687
3-amino-2-chloro-N-(3-fluorophenyl)-N-methylbenzamide
CID 112575829
5-chloro-N-ethyl-2-(ethylamino)-N-(2-ethylbutyl)benzamide
CID 63500077
5-chloro-2-fluoro-N-(4-fluorophenyl)-N-methylbenzamide
CID 61061330
1-ethyl-3-(3-fluorophenyl)-1,3-dimethylurea
CID 116655437
5-chloro-N-[2-(dimethylamino)-2-methylpropyl]-2-(ethylamino)benzamide
CID 62178349

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide?
The IUPAC name of 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide (CID 62173586) is 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide.
What is the SMILES notation for 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide?
The canonical SMILES for 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide is CCNc1ccc(Cl)cc1C(=O)N(C)c1cccc(F)c1.
What is the InChIKey of 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide?
The InChIKey is RJBIHYILUCTFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClFN2O/c1-3-19-15-8-7-11(17)9-14(15)16(21)20(2)13-6-4-5-12(18)10-13/h4-10,19H,3H2,1-2H3.
What are the key properties of 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide?
5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide has a molecular weight of 306.77 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(ethylamino)-N-(3-fluorophenyl)-N-methylbenzamide is sourced from PubChem (CID 62173586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).