N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide

C18H22N2O2 — CID 69313120

IUPACN-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide
SMILESCCNC(=O)CNCc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C18H22N2O2/c1-2-20-18(21)13-19-12-16-9-6-10-17(11-16)22-14-15-7-4-3-5-8-15/h3-11,19H,2,12-14H2,1H3,(H,20,21)
InChIKeyWQQWSYSZUZCQSE-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.49
Rot. Bonds8

About N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide

N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide (PubChem CID 69313120) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide
PubChem CID69313120
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide
SMILESCCNC(=O)CNCc1cccc(OCc2ccccc2)c1
InChIInChI=1S/C18H22N2O2/c1-2-20-18(21)13-19-12-16-9-6-10-17(11-16)22-14-15-7-4-3-5-8-15/h3-11,19H,2,12-14H2,1H3,(H,20,21)
InChIKeyWQQWSYSZUZCQSE-UHFFFAOYSA-N
XLogP2.49
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[(3-phenoxyphenyl)methylamino]acetamide
CID 43398912
N-ethyl-2-(3-phenylmethoxyanilino)acetamide
CID 54826259
N-ethyl-2-[[2-(4-phenylmethoxyphenoxy)acetyl]amino]acetamide
CID 9224487
N-[(3-phenylmethoxyphenyl)methyl]butan-1-amine
CID 4722064
2-[(3-phenylmethoxyphenyl)methylamino]pentanoic acid
CID 120509588
3-[[[2-(ethylamino)-2-oxoethyl]amino]methyl]benzamide
CID 43566996
N-methyl-2-[(4-phenylmethoxyphenyl)methylamino]acetamide
CID 22421272
(2R)-2-[(3-phenylmethoxyphenyl)methylamino]propanoic acid
CID 95003342
ethyl 2-[(6-phenylmethoxynaphthalen-2-yl)methylamino]acetate
CID 86051914
2-[3-[(tert-butylamino)methyl]phenoxy]-N-ethylacetamide
CID 63057746
4-[(3-phenylmethoxyphenyl)methylamino]butan-2-ol
CID 111336616
1-phenylmethoxy-3-propylbenzene
CID 58977798

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide?
The IUPAC name of N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide (CID 69313120) is N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide?
The canonical SMILES for N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide is CCNC(=O)CNCc1cccc(OCc2ccccc2)c1.
What is the InChIKey of N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide?
The InChIKey is WQQWSYSZUZCQSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-2-20-18(21)13-19-12-16-9-6-10-17(11-16)22-14-15-7-4-3-5-8-15/h3-11,19H,2,12-14H2,1H3,(H,20,21).
What are the key properties of N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide?
N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide has a molecular weight of 298.39 g/mol, XLogP of 2.49, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(3-phenylmethoxyphenyl)methylamino]acetamide is sourced from PubChem (CID 69313120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).