N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide

C16H26N2O2 — CID 115952158

IUPACN,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide
SMILESCCN(CC)C(=O)C(C)Oc1c(C)cccc1CNC
InChIInChI=1S/C16H26N2O2/c1-6-18(7-2)16(19)13(4)20-15-12(3)9-8-10-14(15)11-17-5/h8-10,13,17H,6-7,11H2,1-5H3
InChIKeyLCERRBCHGDQJLD-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.35
Rot. Bonds7

About N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide

N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide (PubChem CID 115952158) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide
PubChem CID115952158
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide
SMILESCCN(CC)C(=O)C(C)Oc1c(C)cccc1CNC
InChIInChI=1S/C16H26N2O2/c1-6-18(7-2)16(19)13(4)20-15-12(3)9-8-10-14(15)11-17-5/h8-10,13,17H,6-7,11H2,1-5H3
InChIKeyLCERRBCHGDQJLD-UHFFFAOYSA-N
XLogP2.35
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-methyl-6-(methylaminomethyl)phenoxy]-N-prop-2-ynylpropanamide
CID 112608452
2-[2-(ethylaminomethyl)-6-methylphenoxy]propanamide
CID 112609092
1-[2-(difluoromethoxy)-3-methylphenyl]-N-methylmethanamine
CID 112608407
ethyl 2-[2-methyl-6-(propylaminomethyl)phenoxy]propanoate
CID 115952848
1-[2-methyl-6-(methylaminomethyl)phenoxy]propan-2-ol
CID 112608228
2-[2-methyl-6-(methylaminomethyl)phenoxy]butanenitrile
CID 112608340
N-cyclopropyl-2-[2-(ethylaminomethyl)-6-methylphenoxy]propanamide
CID 115952731
2-(4-cyano-2,6-dimethylphenoxy)-N,N-diethylpropanamide
CID 65471517
2-[2-(hydroxymethyl)-6-methylphenoxy]-N-propylpropanamide
CID 112612370
2-[1-(diethylamino)-1-oxopropan-2-yl]oxy-3-fluorobenzoic acid
CID 115956001
N-ethyl-2-methyl-3-(methylamino)-N-[(2-methylphenyl)methyl]propanamide;hydrochloride
CID 119722155
(2S)-2-(3-chlorophenoxy)-N,N-diethylpropanamide
CID 40538344

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide?
The IUPAC name of N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide (CID 115952158) is N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide.
What is the SMILES notation for N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide?
The canonical SMILES for N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide is CCN(CC)C(=O)C(C)Oc1c(C)cccc1CNC.
What is the InChIKey of N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide?
The InChIKey is LCERRBCHGDQJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-6-18(7-2)16(19)13(4)20-15-12(3)9-8-10-14(15)11-17-5/h8-10,13,17H,6-7,11H2,1-5H3.
What are the key properties of N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide?
N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide has a molecular weight of 278.40 g/mol, XLogP of 2.35, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[2-methyl-6-(methylaminomethyl)phenoxy]propanamide is sourced from PubChem (CID 115952158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).