N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide

C16H27N3O3 — CID 119865025

IUPACN-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide
SMILESCCN(CC)CCOc1cc(NC(=O)CNC)ccc1OC
InChIInChI=1S/C16H27N3O3/c1-5-19(6-2)9-10-22-15-11-13(7-8-14(15)21-4)18-16(20)12-17-3/h7-8,11,17H,5-6,9-10,12H2,1-4H3,(H,18,20)
InChIKeyFDNQGRXHEGNPIM-UHFFFAOYSA-N
MW309.41 g/mol
LogP1.57
Rot. Bonds10

About N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide

N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide (PubChem CID 119865025) has the molecular formula C16H27N3O3 and a molecular weight of 309.41 g/mol. Its IUPAC name is N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide
PubChem CID119865025
Molecular FormulaC16H27N3O3
Molecular Weight309.41 g/mol
Exact Mass309.21
IUPAC NameN-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide
SMILESCCN(CC)CCOc1cc(NC(=O)CNC)ccc1OC
InChIInChI=1S/C16H27N3O3/c1-5-19(6-2)9-10-22-15-11-13(7-8-14(15)21-4)18-16(20)12-17-3/h7-8,11,17H,5-6,9-10,12H2,1-4H3,(H,18,20)
InChIKeyFDNQGRXHEGNPIM-UHFFFAOYSA-N
XLogP1.57
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(2-fluorophenyl)sulfanylacetamide
CID 47089567
(2S)-2-amino-N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-3,3-dimethylbutanamide;dihydrochloride
CID 119865034
1-cyclopentyl-3-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]urea
CID 60612121
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]piperidine-4-carboxamide
CID 119865015
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]thiophene-2-carboxamide
CID 22459278
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]piperidine-4-carboxamide;dihydrochloride
CID 119865014
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide
CID 56988348
N-(3,4-diethoxyphenyl)-2-(methylamino)acetamide
CID 2452186
2-(diethylamino)-N-(3,4-dimethoxyphenyl)acetamide
CID 11521836
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-5-methoxy-2-methyl-1H-indole-3-carboxamide
CID 167866171
1-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-3-[2-(4-fluorophenyl)ethyl]urea
CID 60612179
(2S,4S)-N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-methylpiperidine-4-carboxamide
CID 120645414

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide?
The IUPAC name of N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide (CID 119865025) is N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide?
The canonical SMILES for N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide is CCN(CC)CCOc1cc(NC(=O)CNC)ccc1OC.
What is the InChIKey of N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide?
The InChIKey is FDNQGRXHEGNPIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O3/c1-5-19(6-2)9-10-22-15-11-13(7-8-14(15)21-4)18-16(20)12-17-3/h7-8,11,17H,5-6,9-10,12H2,1-4H3,(H,18,20).
What are the key properties of N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide?
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide has a molecular weight of 309.41 g/mol, XLogP of 1.57, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-2-(methylamino)acetamide is sourced from PubChem (CID 119865025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).