N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide

C19H22F2N2O2 — CID 51244088

IUPACN-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide
SMILESCOc1ccc(C)cc1C(C)NC(C)C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C19H22F2N2O2/c1-11-5-8-18(25-4)15(9-11)12(2)22-13(3)19(24)23-17-7-6-14(20)10-16(17)21/h5-10,12-13,22H,1-4H3,(H,23,24)
InChIKeyXERYMBZZENCXID-UHFFFAOYSA-N
MW348.39 g/mol
LogP3.96
Rot. Bonds6

About N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide

N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide (PubChem CID 51244088) has the molecular formula C19H22F2N2O2 and a molecular weight of 348.39 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide
PubChem CID51244088
Molecular FormulaC19H22F2N2O2
Molecular Weight348.39 g/mol
Exact Mass348.16
IUPAC NameN-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide
SMILESCOc1ccc(C)cc1C(C)NC(C)C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C19H22F2N2O2/c1-11-5-8-18(25-4)15(9-11)12(2)22-13(3)19(24)23-17-7-6-14(20)10-16(17)21/h5-10,12-13,22H,1-4H3,(H,23,24)
InChIKeyXERYMBZZENCXID-UHFFFAOYSA-N
XLogP3.96
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.39
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dimethylphenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide
CID 51244084
N-(2,4-difluorophenyl)-2-[1-(2-fluorophenyl)ethylamino]propanamide
CID 18094383
1-(2,4-difluorophenyl)-3-[1-(2,5-dimethoxyphenyl)ethyl]urea
CID 2955398
N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
CID 44998456
(2S)-2-[[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]amino]-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 94180754
(2S)-N-(2,4-difluorophenyl)-2-(2-methoxyanilino)propanamide
CID 9274019
N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)propanediamide
CID 108955812
(2S)-N-(5-chloro-2-methoxyphenyl)-2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]propanamide
CID 7590323
N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133219467
N-(2,4-difluorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 53286451
(2S)-2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-N-(2-methoxy-5-methylphenyl)propanamide
CID 51925556
[(2S)-1-(2,4-difluoroanilino)-1-oxopropan-2-yl] 5-chloro-2-methoxybenzoate
CID 8738420

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide (CID 51244088) is N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide is COc1ccc(C)cc1C(C)NC(C)C(=O)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide?
The InChIKey is XERYMBZZENCXID-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F2N2O2/c1-11-5-8-18(25-4)15(9-11)12(2)22-13(3)19(24)23-17-7-6-14(20)10-16(17)21/h5-10,12-13,22H,1-4H3,(H,23,24).
What are the key properties of N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide?
N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide has a molecular weight of 348.39 g/mol, XLogP of 3.96, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide is sourced from PubChem (CID 51244088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).