N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide

C17H26N2O4 — CID 86825214

IUPACN-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
SMILESCOc1ccc(NC(=O)CN(C)CC2CCCCO2)c(OC)c1
InChIInChI=1S/C17H26N2O4/c1-19(11-14-6-4-5-9-23-14)12-17(20)18-15-8-7-13(21-2)10-16(15)22-3/h7-8,10,14H,4-6,9,11-12H2,1-3H3,(H,18,20)
InChIKeyGUZUDLJLUMJBIF-UHFFFAOYSA-N
MW322.40 g/mol
LogP2.14
Rot. Bonds7

About N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide

N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide (PubChem CID 86825214) has the molecular formula C17H26N2O4 and a molecular weight of 322.40 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
PubChem CID86825214
Molecular FormulaC17H26N2O4
Molecular Weight322.40 g/mol
Exact Mass322.19
IUPAC NameN-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
SMILESCOc1ccc(NC(=O)CN(C)CC2CCCCO2)c(OC)c1
InChIInChI=1S/C17H26N2O4/c1-19(11-14-6-4-5-9-23-14)12-17(20)18-15-8-7-13(21-2)10-16(15)22-3/h7-8,10,14H,4-6,9,11-12H2,1-3H3,(H,18,20)
InChIKeyGUZUDLJLUMJBIF-UHFFFAOYSA-N
XLogP2.14
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.40
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-3-[methyl(oxan-2-ylmethyl)amino]propanamide
CID 91842038
N-(3-methoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 78722797
3-(2,4-dimethoxyphenyl)-1-methyl-1-[2-[(2R)-oxan-2-yl]ethyl]urea
CID 124523163
N-(2,4-difluorophenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86825234
N-(2-bromo-4-methylphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86825232
N-(4-amino-2-methylphenyl)-2-[methyl(oxolan-2-ylmethyl)amino]acetamide
CID 61431738
N-(2,4-dimethoxyphenyl)-2-[methyl(propyl)amino]acetamide
CID 47085287
N-(2-methyl-5-nitrophenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86825215
N-(4-amino-2-methoxyphenyl)-2-[cyclobutylmethyl(methyl)amino]acetamide
CID 62861269
1-(3-chloro-4-methoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]ethanone
CID 61432505
N-(3-fluorophenyl)-2-[methyl-[[(2S)-oxan-2-yl]methyl]amino]acetamide
CID 9223762
2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-N-(2,4-dimethoxyphenyl)acetamide
CID 8692437

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide (CID 86825214) is N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide is COc1ccc(NC(=O)CN(C)CC2CCCCO2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide?
The InChIKey is GUZUDLJLUMJBIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O4/c1-19(11-14-6-4-5-9-23-14)12-17(20)18-15-8-7-13(21-2)10-16(15)22-3/h7-8,10,14H,4-6,9,11-12H2,1-3H3,(H,18,20).
What are the key properties of N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide?
N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide has a molecular weight of 322.40 g/mol, XLogP of 2.14, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 86825214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).