2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide

C15H24N2O4 — CID 43587285

IUPAC2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide
SMILESCOCCN(CCOC)C(=O)COc1ccc(CN)cc1
InChIInChI=1S/C15H24N2O4/c1-19-9-7-17(8-10-20-2)15(18)12-21-14-5-3-13(11-16)4-6-14/h3-6H,7-12,16H2,1-2H3
InChIKeyXNTSRCKJNJBLRW-UHFFFAOYSA-N
MW296.37 g/mol
LogP0.65
Rot. Bonds10

About 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide

2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide (PubChem CID 43587285) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide
PubChem CID43587285
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide
SMILESCOCCN(CCOC)C(=O)COc1ccc(CN)cc1
InChIInChI=1S/C15H24N2O4/c1-19-9-7-17(8-10-20-2)15(18)12-21-14-5-3-13(11-16)4-6-14/h3-6H,7-12,16H2,1-2H3
InChIKeyXNTSRCKJNJBLRW-UHFFFAOYSA-N
XLogP0.65
TPSA74.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-ethoxyphenoxy)-N-(2-hydroxyethyl)-N-(2-methoxyethyl)acetamide
CID 115902367
2-(3,4-dimethylphenoxy)-N,N-bis(2-methoxyethyl)acetamide
CID 78760333
N,N-bis(2-methoxyethyl)-2-(3-methylphenoxy)acetamide
CID 78762157
N,N-bis(2-methoxyethyl)-2-naphthalen-2-yloxyacetamide
CID 78763769
2-[[2-[4-(aminomethyl)phenoxy]acetyl]-methylamino]acetamide
CID 43373935
2-(4-aminophenoxy)-N-(2-methoxyethyl)-N-methylacetamide
CID 61126914
N-(3-aminopropyl)-N-(2-methoxyethyl)-2-(4-methoxyphenyl)acetamide
CID 63287501
2-[4-(aminomethyl)phenoxy]-N-cyclopropyl-N-ethylacetamide
CID 43263738
2-(3,5-dimethylphenoxy)-N-(2-hydroxyethyl)-N-(2-methoxyethyl)acetamide
CID 115902469
N-benzyl-2-[4-(4-fluorobenzoyl)phenoxy]-N-(2-methoxyethyl)acetamide
CID 9289798
[4-(2-methylprop-2-enoxy)phenyl]methanamine
CID 54793590
2-[4-(aminomethyl)phenoxy]-N-ethyl-N-phenylacetamide
CID 16787196

Frequently Asked Questions

What is the IUPAC name of 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide?
The IUPAC name of 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide (CID 43587285) is 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide is COCCN(CCOC)C(=O)COc1ccc(CN)cc1.
What is the InChIKey of 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide?
The InChIKey is XNTSRCKJNJBLRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-19-9-7-17(8-10-20-2)15(18)12-21-14-5-3-13(11-16)4-6-14/h3-6H,7-12,16H2,1-2H3.
What are the key properties of 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide?
2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide has a molecular weight of 296.37 g/mol, XLogP of 0.65, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(aminomethyl)phenoxy]-N,N-bis(2-methoxyethyl)acetamide is sourced from PubChem (CID 43587285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).