N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide

C14H17F3N2O — CID 62167915

IUPACN-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide
SMILESCCNc1ccc(C(=O)N(C)C2CC2)cc1C(F)(F)F
InChIInChI=1S/C14H17F3N2O/c1-3-18-12-7-4-9(8-11(12)14(15,16)17)13(20)19(2)10-5-6-10/h4,7-8,10,18H,3,5-6H2,1-2H3
InChIKeyATAWWWBKSJKQOM-UHFFFAOYSA-N
MW286.30 g/mol
LogP3.37
Rot. Bonds4

About N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide

N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide (PubChem CID 62167915) has the molecular formula C14H17F3N2O and a molecular weight of 286.30 g/mol. Its IUPAC name is N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide
PubChem CID62167915
Molecular FormulaC14H17F3N2O
Molecular Weight286.30 g/mol
Exact Mass286.13
IUPAC NameN-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide
SMILESCCNc1ccc(C(=O)N(C)C2CC2)cc1C(F)(F)F
InChIInChI=1S/C14H17F3N2O/c1-3-18-12-7-4-9(8-11(12)14(15,16)17)13(20)19(2)10-5-6-10/h4,7-8,10,18H,3,5-6H2,1-2H3
InChIKeyATAWWWBKSJKQOM-UHFFFAOYSA-N
XLogP3.37
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(ethylamino)-N-propyl-3-(trifluoromethyl)benzamide
CID 62171618
N-cyclopropyl-N-ethyl-4-hydrazinyl-3-(trifluoromethyl)benzamide
CID 62242272
N-(1-cyclopropylethyl)-4-(ethylamino)-3-(trifluoromethyl)benzamide
CID 62168331
4-(ethylamino)-N-(2-methylcyclopropyl)-3-(trifluoromethyl)benzamide
CID 62409438
N-ethyl-4-hydrazinyl-N-methyl-3-(trifluoromethyl)benzamide
CID 62241169
N-cyclopropyl-2-(ethylamino)-N,5-dimethylbenzamide
CID 62508986
4-(ethylamino)-N-pentyl-3-(trifluoromethyl)benzamide
CID 62186743
4-amino-N-cyclohexyl-N-methyl-3-(trifluoromethyl)benzamide
CID 62156411
N-methyl-4-(methylamino)-N-(2-methylbutan-2-yl)-3-(trifluoromethyl)benzamide
CID 63961442
N-[4-(ethylamino)cyclohexyl]-3,4-difluoro-N-methylbenzamide
CID 79116508
N-[2-(dimethylamino)ethyl]-4-hydrazinyl-N-methyl-3-(trifluoromethyl)benzamide
CID 63726381
N-cyclopropyl-4-(ethylamino)-3-methyl-N-propylbenzamide
CID 63210133

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide?
The IUPAC name of N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide (CID 62167915) is N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide.
What is the SMILES notation for N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide?
The canonical SMILES for N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide is CCNc1ccc(C(=O)N(C)C2CC2)cc1C(F)(F)F.
What is the InChIKey of N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide?
The InChIKey is ATAWWWBKSJKQOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O/c1-3-18-12-7-4-9(8-11(12)14(15,16)17)13(20)19(2)10-5-6-10/h4,7-8,10,18H,3,5-6H2,1-2H3.
What are the key properties of N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide?
N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide has a molecular weight of 286.30 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-(ethylamino)-N-methyl-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 62167915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).