N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide

C15H19F3N2O — CID 104547771

IUPACN-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide
SMILESCNCCc1ccccc1C(=O)N(CC(F)(F)F)C1CC1
InChIInChI=1S/C15H19F3N2O/c1-19-9-8-11-4-2-3-5-13(11)14(21)20(12-6-7-12)10-15(16,17)18/h2-5,12,19H,6-10H2,1H3
InChIKeySTNAGFKFNSZCLY-UHFFFAOYSA-N
MW300.32 g/mol
LogP2.62
Rot. Bonds6

About N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide

N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide (PubChem CID 104547771) has the molecular formula C15H19F3N2O and a molecular weight of 300.32 g/mol. Its IUPAC name is N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide
PubChem CID104547771
Molecular FormulaC15H19F3N2O
Molecular Weight300.32 g/mol
Exact Mass300.14
IUPAC NameN-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide
SMILESCNCCc1ccccc1C(=O)N(CC(F)(F)F)C1CC1
InChIInChI=1S/C15H19F3N2O/c1-19-9-8-11-4-2-3-5-13(11)14(21)20(12-6-7-12)10-15(16,17)18/h2-5,12,19H,6-10H2,1H3
InChIKeySTNAGFKFNSZCLY-UHFFFAOYSA-N
XLogP2.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-2-(propan-2-ylamino)-N-(2,2,2-trifluoroethyl)benzamide
CID 63108556
N-methyl-2-[2-(methylamino)ethyl]-N-(1-methylpiperidin-4-yl)benzamide
CID 104547292
N-methyl-2-[2-(methylamino)ethyl]-N-(oxan-4-yl)benzamide
CID 104547501
N-cyclopropyl-N-(2,2,2-trifluoroethyl)benzamide
CID 61410101
2-bromo-N-cyclopropyl-3-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 103857135
N,N-diethyl-2-[2-(methylamino)ethyl]benzamide
CID 104547231
N-methyl-N,2-bis[2-(methylamino)ethyl]benzamide
CID 104547950
2,2-dimethyl-1-[2-[2-(methylamino)ethyl]phenyl]propan-1-one
CID 116613271
N-tert-butyl-2-[2-(methylamino)ethyl]-N-prop-2-enylbenzamide
CID 104548197
2-fluoro-N-(oxan-4-yl)-N-(2,2,2-trifluoroethyl)benzamide
CID 90554720
N-methoxy-N-methyl-2-[2-(methylamino)ethyl]benzamide
CID 104547715
2-[2-(methylamino)ethyl]benzamide
CID 69094527

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide?
The IUPAC name of N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide (CID 104547771) is N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide.
What is the SMILES notation for N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide?
The canonical SMILES for N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide is CNCCc1ccccc1C(=O)N(CC(F)(F)F)C1CC1.
What is the InChIKey of N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide?
The InChIKey is STNAGFKFNSZCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O/c1-19-9-8-11-4-2-3-5-13(11)14(21)20(12-6-7-12)10-15(16,17)18/h2-5,12,19H,6-10H2,1H3.
What are the key properties of N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide?
N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide has a molecular weight of 300.32 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[2-(methylamino)ethyl]-N-(2,2,2-trifluoroethyl)benzamide is sourced from PubChem (CID 104547771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).