N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide

C13H20N2O2 — CID 43406781

IUPACN-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide
SMILESCCNC(=O)CNCc1cc(C)ccc1OC
InChIInChI=1S/C13H20N2O2/c1-4-15-13(16)9-14-8-11-7-10(2)5-6-12(11)17-3/h5-7,14H,4,8-9H2,1-3H3,(H,15,16)
InChIKeyCXUDUERXHFZBNU-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.23
Rot. Bonds6

About N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide

N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide (PubChem CID 43406781) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide
PubChem CID43406781
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide
SMILESCCNC(=O)CNCc1cc(C)ccc1OC
InChIInChI=1S/C13H20N2O2/c1-4-15-13(16)9-14-8-11-7-10(2)5-6-12(11)17-3/h5-7,14H,4,8-9H2,1-3H3,(H,15,16)
InChIKeyCXUDUERXHFZBNU-UHFFFAOYSA-N
XLogP1.23
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[(2-fluoro-5-methylphenyl)methylamino]acetamide
CID 115632183
N-[(2-methoxy-5-methylphenyl)methyl]acetamide
CID 110779845
N-[(2-methoxy-5-methylphenyl)methyl]-3-sulfanylpropanamide
CID 115167821
2-[[2-(2-methoxy-5-methylphenyl)acetyl]amino]acetic acid
CID 43241710
3-[(2-methoxy-5-methylphenyl)methylamino]-3-oxopropanoic acid
CID 115163375
2-chloro-N-[(2-methoxy-5-methylphenyl)methyl]acetamide
CID 82128305
2-(2-methoxy-5-methylphenyl)-N-methylacetamide
CID 39969431
3-hydroxy-N-[(2-methoxy-5-methylphenyl)methyl]propanamide
CID 115138980
N-[(5-chloro-2-methoxyphenyl)methyl]-2-(ethylamino)acetamide
CID 115157863
3-[(2-methoxy-5-methylphenyl)methylamino]propanamide
CID 43423932
2-(2,5-dimethoxyphenyl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
CID 78823018
2-[(4-ethoxy-3-methoxyphenyl)methylamino]-N-ethylacetamide
CID 43398915

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide?
The IUPAC name of N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide (CID 43406781) is N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide?
The canonical SMILES for N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide is CCNC(=O)CNCc1cc(C)ccc1OC.
What is the InChIKey of N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide?
The InChIKey is CXUDUERXHFZBNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-15-13(16)9-14-8-11-7-10(2)5-6-12(11)17-3/h5-7,14H,4,8-9H2,1-3H3,(H,15,16).
What are the key properties of N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide?
N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide has a molecular weight of 236.31 g/mol, XLogP of 1.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(2-methoxy-5-methylphenyl)methylamino]acetamide is sourced from PubChem (CID 43406781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).