N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide

C13H20N2O3 — CID 54938253

IUPACN-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide
SMILESCCNC(=O)CNCC(O)c1ccc(OC)cc1
InChIInChI=1S/C13H20N2O3/c1-3-15-13(17)9-14-8-12(16)10-4-6-11(18-2)7-5-10/h4-7,12,14,16H,3,8-9H2,1-2H3,(H,15,17)
InChIKeyJOUIBIPQGQQVCM-UHFFFAOYSA-N
MW252.31 g/mol
LogP0.45
Rot. Bonds7

About N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide

N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide (PubChem CID 54938253) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide
PubChem CID54938253
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC NameN-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide
SMILESCCNC(=O)CNCC(O)c1ccc(OC)cc1
InChIInChI=1S/C13H20N2O3/c1-3-15-13(17)9-14-8-12(16)10-4-6-11(18-2)7-5-10/h4-7,12,14,16H,3,8-9H2,1-2H3,(H,15,17)
InChIKeyJOUIBIPQGQQVCM-UHFFFAOYSA-N
XLogP0.45
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]propanamide
CID 61476867
[2-hydroxy-2-(4-methoxyphenyl)ethyl]urea
CID 137321016
2-cycloheptyl-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]acetamide
CID 111829496
2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]ethyl carbamate
CID 83209205
N-[(2R)-2-hydroxy-2-(4-methoxyphenyl)ethyl]-2-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 97202298
1-(4-methoxyphenyl)-2-(prop-2-ynylamino)ethanol
CID 60903384
N-[2-(ethylamino)-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 9224356
1,1-difluoro-3-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]propan-2-ol
CID 114093465
2-hydrazinyl-1-(4-methoxyphenyl)ethanol
CID 21361112
4-amino-N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]butanamide;hydrochloride
CID 119293246
2-[2-amino-2-(4-methoxyphenyl)ethyl]sulfanyl-N-ethylacetamide
CID 114234940
2-[[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]amino]acetic acid
CID 82314145

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide?
The IUPAC name of N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide (CID 54938253) is N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide is CCNC(=O)CNCC(O)c1ccc(OC)cc1.
What is the InChIKey of N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide?
The InChIKey is JOUIBIPQGQQVCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-3-15-13(17)9-14-8-12(16)10-4-6-11(18-2)7-5-10/h4-7,12,14,16H,3,8-9H2,1-2H3,(H,15,17).
What are the key properties of N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide?
N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide has a molecular weight of 252.31 g/mol, XLogP of 0.45, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]acetamide is sourced from PubChem (CID 54938253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).