N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide

C13H20N2O3 — CID 61207330

IUPACN-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide
SMILESCOCCc1ccc(OCC(=O)NCCN)cc1
InChIInChI=1S/C13H20N2O3/c1-17-9-6-11-2-4-12(5-3-11)18-10-13(16)15-8-7-14/h2-5H,6-10,14H2,1H3,(H,15,16)
InChIKeyPWPNNYGSYQKXIJ-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.33
Rot. Bonds8

About N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide

N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide (PubChem CID 61207330) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide
PubChem CID61207330
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC NameN-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide
SMILESCOCCc1ccc(OCC(=O)NCCN)cc1
InChIInChI=1S/C13H20N2O3/c1-17-9-6-11-2-4-12(5-3-11)18-10-13(16)15-8-7-14/h2-5H,6-10,14H2,1H3,(H,15,16)
InChIKeyPWPNNYGSYQKXIJ-UHFFFAOYSA-N
XLogP0.33
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminoethyl)-2-(4-pentoxyphenoxy)acetamide
CID 102457395
N-(2-aminoethyl)-2-(4-benzylphenoxy)acetamide
CID 62275392
N-(2-aminoethyl)-2-(4-bromophenoxy)acetamide;hydrochloride
CID 119382433
2-(4-hydroxyphenoxy)-N-(2-methoxyethyl)acetamide
CID 61485470
N-(2-aminoethyl)-2-(4-iodophenoxy)acetamide;hydrochloride
CID 119384507
N-(2-aminoethyl)-2-(4-propan-2-ylphenoxy)acetamide;hydrochloride
CID 119384409
2-[4-[2-(3-methoxypropanoylamino)ethyl]phenoxy]acetic acid
CID 119255509
N-(5-chloro-2-methylphenyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide
CID 8833683
2-[4-(2-aminoethyl)phenoxy]-N-(2-methylpropyl)acetamide
CID 16773407
methyl 2-[4-(2-aminoethyl)phenoxy]acetate
CID 15674417
2-[4-(2-methoxyethyl)phenoxy]ethanethioamide
CID 43352082
methyl 4-[[2-[4-(aminomethyl)phenoxy]acetyl]amino]butanoate
CID 106484765

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide?
The IUPAC name of N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide (CID 61207330) is N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide.
What is the SMILES notation for N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide?
The canonical SMILES for N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide is COCCc1ccc(OCC(=O)NCCN)cc1.
What is the InChIKey of N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide?
The InChIKey is PWPNNYGSYQKXIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-17-9-6-11-2-4-12(5-3-11)18-10-13(16)15-8-7-14/h2-5H,6-10,14H2,1H3,(H,15,16).
What are the key properties of N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide?
N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide has a molecular weight of 252.31 g/mol, XLogP of 0.33, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-[4-(2-methoxyethyl)phenoxy]acetamide is sourced from PubChem (CID 61207330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).