3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide

C14H22N2O2 — CID 62834607

IUPAC3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide
SMILESCCNCCC(=O)NC(C)c1ccccc1OC
InChIInChI=1S/C14H22N2O2/c1-4-15-10-9-14(17)16-11(2)12-7-5-6-8-13(12)18-3/h5-8,11,15H,4,9-10H2,1-3H3,(H,16,17)
InChIKeyMFFUPPMZOHMEQE-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.87
Rot. Bonds7

About 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide

3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide (PubChem CID 62834607) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide.

Molecular Properties

Compound Name3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide
PubChem CID62834607
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide
SMILESCCNCCC(=O)NC(C)c1ccccc1OC
InChIInChI=1S/C14H22N2O2/c1-4-15-10-9-14(17)16-11(2)12-7-5-6-8-13(12)18-3/h5-8,11,15H,4,9-10H2,1-3H3,(H,16,17)
InChIKeyMFFUPPMZOHMEQE-UHFFFAOYSA-N
XLogP1.87
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(1R)-1-(2-methoxyphenyl)ethyl]-4-(methylamino)butanamide
CID 81387871
3-(ethylamino)-N-[(1R)-1-(2-methoxyphenyl)ethyl]butanamide
CID 81387789
2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide
CID 81387481
3-(3,4-dimethylphenyl)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 133160279
3-cyclopentyl-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 78771407
2-(2-ethylphenoxy)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 51144695
3-(furan-2-yl)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 47097123
N-[1-(2-methoxyphenyl)ethyl]-3-naphthalen-1-ylpropanamide
CID 133184843
2-amino-N-[2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]-2-oxoethyl]acetamide
CID 81387632
3-(aminomethyl)-N-[1-(2-methoxyphenyl)ethyl]pentanamide
CID 81087802
2-cyclohexyl-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 51144509
3-(4-chlorophenyl)sulfanyl-N-[(1R)-1-(2-methoxyphenyl)ethyl]propanamide
CID 26618385

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The IUPAC name of 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide (CID 62834607) is 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide.
What is the SMILES notation for 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The canonical SMILES for 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide is CCNCCC(=O)NC(C)c1ccccc1OC.
What is the InChIKey of 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide?
The InChIKey is MFFUPPMZOHMEQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-4-15-10-9-14(17)16-11(2)12-7-5-6-8-13(12)18-3/h5-8,11,15H,4,9-10H2,1-3H3,(H,16,17).
What are the key properties of 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide?
3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide has a molecular weight of 250.34 g/mol, XLogP of 1.87, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide is sourced from PubChem (CID 62834607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).