N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide

C17H18F2N2O — CID 7897282

IUPACN-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide
SMILESCN(C)[C@@H](CNC(=O)c1cc(F)cc(F)c1)c1ccccc1
InChIInChI=1S/C17H18F2N2O/c1-21(2)16(12-6-4-3-5-7-12)11-20-17(22)13-8-14(18)10-15(19)9-13/h3-10,16H,11H2,1-2H3,(H,20,22)/t16-/m0/s1
InChIKeySDNDFXUSMLLOMH-INIZCTEOSA-N
MW304.34 g/mol
LogP3.00
Rot. Bonds5

About N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide

N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide (PubChem CID 7897282) has the molecular formula C17H18F2N2O and a molecular weight of 304.34 g/mol. Its IUPAC name is N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide.

Molecular Properties

Compound NameN-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide
PubChem CID7897282
Molecular FormulaC17H18F2N2O
Molecular Weight304.34 g/mol
Exact Mass304.14
IUPAC NameN-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide
SMILESCN(C)[C@@H](CNC(=O)c1cc(F)cc(F)c1)c1ccccc1
InChIInChI=1S/C17H18F2N2O/c1-21(2)16(12-6-4-3-5-7-12)11-20-17(22)13-8-14(18)10-15(19)9-13/h3-10,16H,11H2,1-2H3,(H,20,22)/t16-/m0/s1
InChIKeySDNDFXUSMLLOMH-INIZCTEOSA-N
XLogP3.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.34
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide 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

N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-3,5-difluorobenzamide
CID 51179438
N-[2-(dimethylamino)-2-phenylethyl]benzamide;hydrochloride
CID 20994991
[(1R)-2-[(3,5-difluorobenzoyl)amino]-1-phenylethyl]-dimethylazanium
CID 7897281
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3-methylbenzamide
CID 2421982
N-[(2R)-2-(dimethylamino)-2-phenylethyl]pyridine-4-carboxamide
CID 32730765
4-tert-butyl-N-[2-(dimethylamino)-2-phenylethyl]benzamide
CID 45001444
3-(dimethylamino)-N-[2-(dimethylamino)-2-phenylethyl]benzamide
CID 42891486
N-[2-(dimethylamino)-2-phenylethyl]-5-iodothiophene-3-carboxamide
CID 78949054
3-acetamido-N-[(2S)-2-(dimethylamino)-2-phenylethyl]benzamide
CID 27230301
N-[2-(dimethylamino)-2-(3-fluorophenyl)ethyl]-4-methylbenzamide
CID 51186635
3-acetamido-N-[2-(dimethylamino)-2-phenylethyl]benzamide
CID 42910974
N-[2-(dimethylamino)-2-phenylethyl]-3-pyrrol-1-ylbenzamide
CID 110301921

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide?
The IUPAC name of N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide (CID 7897282) is N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide.
What is the SMILES notation for N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide?
The canonical SMILES for N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide is CN(C)[C@@H](CNC(=O)c1cc(F)cc(F)c1)c1ccccc1.
What is the InChIKey of N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide?
The InChIKey is SDNDFXUSMLLOMH-INIZCTEOSA-N. The full InChI is InChI=1S/C17H18F2N2O/c1-21(2)16(12-6-4-3-5-7-12)11-20-17(22)13-8-14(18)10-15(19)9-13/h3-10,16H,11H2,1-2H3,(H,20,22)/t16-/m0/s1.
What are the key properties of N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide?
N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide has a molecular weight of 304.34 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(dimethylamino)-2-phenylethyl]-3,5-difluorobenzamide is sourced from PubChem (CID 7897282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).