N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide

C19H22ClFN2O2 — CID 18094687

IUPACN-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide
SMILESCC(C(=O)NCc1ccccc1Cl)N(C)CCOc1ccccc1F
InChIInChI=1S/C19H22ClFN2O2/c1-14(19(24)22-13-15-7-3-4-8-16(15)20)23(2)11-12-25-18-10-6-5-9-17(18)21/h3-10,14H,11-13H2,1-2H3,(H,22,24)
InChIKeyGECLSTMFVMXMKG-UHFFFAOYSA-N
MW364.85 g/mol
LogP3.49
Rot. Bonds8

About N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide

N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide (PubChem CID 18094687) has the molecular formula C19H22ClFN2O2 and a molecular weight of 364.85 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide
PubChem CID18094687
Molecular FormulaC19H22ClFN2O2
Molecular Weight364.85 g/mol
Exact Mass364.14
IUPAC NameN-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide
SMILESCC(C(=O)NCc1ccccc1Cl)N(C)CCOc1ccccc1F
InChIInChI=1S/C19H22ClFN2O2/c1-14(19(24)22-13-15-7-3-4-8-16(15)20)23(2)11-12-25-18-10-6-5-9-17(18)21/h3-10,14H,11-13H2,1-2H3,(H,22,24)
InChIKeyGECLSTMFVMXMKG-UHFFFAOYSA-N
XLogP3.49
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.85
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide
CID 55432130
2-[2-(2-chlorophenoxy)ethyl-methylamino]-N-(2,4-difluorophenyl)propanamide
CID 46631679
(2S)-N-[(2-fluorophenyl)methyl]-2-[methyl(propyl)amino]propanamide
CID 95262158
2-[2-(2-chlorophenoxy)ethyl-methylamino]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 24507754
N-benzyl-2-[2-(4-fluorophenoxy)ethyl-methylamino]propanamide
CID 74519943
N-[2-(2-fluorophenoxy)ethyl]-2-methylpropanamide
CID 110478459
N-[(2-chlorophenyl)methyl]-2-[2-(4-fluorophenoxy)ethyl-methylamino]acetamide
CID 9333391
(2S)-N-benzyl-2-[methyl-[2-(2-methylphenoxy)ethyl]amino]propanamide
CID 27123609
N-[(2-chlorophenyl)methyl]-2-[(3-chlorophenyl)methyl-methylamino]propanamide
CID 18094060
N-[(2-chlorophenyl)methyl]-2-[(4-fluorophenyl)methyl-(2-phenoxyacetyl)amino]propanamide
CID 133213172
2-[(2-chlorophenyl)methyl-[2-(2-fluorophenoxy)acetyl]amino]-N-methylpropanamide
CID 132656883
N-[(2-chlorophenyl)methyl]-3-(2-methylphenoxy)propanamide
CID 7973168

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide (CID 18094687) is N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide is CC(C(=O)NCc1ccccc1Cl)N(C)CCOc1ccccc1F.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide?
The InChIKey is GECLSTMFVMXMKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClFN2O2/c1-14(19(24)22-13-15-7-3-4-8-16(15)20)23(2)11-12-25-18-10-6-5-9-17(18)21/h3-10,14H,11-13H2,1-2H3,(H,22,24).
What are the key properties of N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide?
N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide has a molecular weight of 364.85 g/mol, XLogP of 3.49, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-2-[2-(2-fluorophenoxy)ethyl-methylamino]propanamide is sourced from PubChem (CID 18094687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).