2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide

C15H24N2O3 — CID 8683962

IUPAC2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide
SMILESCCNC(=O)CN(CC)Cc1cc(OC)ccc1OC
InChIInChI=1S/C15H24N2O3/c1-5-16-15(18)11-17(6-2)10-12-9-13(19-3)7-8-14(12)20-4/h7-9H,5-6,10-11H2,1-4H3,(H,16,18)
InChIKeySDOMQXVPUJHHEL-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.66
Rot. Bonds8

About 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide

2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide (PubChem CID 8683962) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide.

Molecular Properties

Compound Name2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide
PubChem CID8683962
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide
SMILESCCNC(=O)CN(CC)Cc1cc(OC)ccc1OC
InChIInChI=1S/C15H24N2O3/c1-5-16-15(18)11-17(6-2)10-12-9-13(19-3)7-8-14(12)20-4/h7-9H,5-6,10-11H2,1-4H3,(H,16,18)
InChIKeySDOMQXVPUJHHEL-UHFFFAOYSA-N
XLogP1.66
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-[ethyl-[(2-hydroxy-4-methoxyphenyl)methyl]amino]acetamide
CID 82986658
2-[(3,4-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide
CID 32661950
N-ethyl-2-[ethyl-[(7-methoxy-2-oxochromen-4-yl)methyl]amino]acetamide
CID 9433203
2-(2,5-dimethoxyphenyl)-N-[2-(ethylamino)-2-oxoethyl]acetamide
CID 78823018
2-[ethyl-[(2-hydroxy-5-methoxyphenyl)methyl]amino]acetamide
CID 103104516
2-(diethylamino)-N-(2,5-dimethoxyphenyl)acetamide
CID 11666162
2-[(5-bromo-2-methoxyphenyl)methyl-ethylamino]-N-propan-2-ylacetamide
CID 47117609
2-[(2,5-dimethoxyphenyl)sulfonyl-methylamino]-N-ethylacetamide
CID 45371745
2-[(2,5-dimethoxyphenyl)methyl-(2-methoxyethyl)amino]acetic acid
CID 39382765
2-[(5-chloro-2-hydroxyphenyl)methyl-ethylamino]-N-ethylacetamide
CID 82986726
2-(2,5-dimethoxyphenyl)-N-methoxyacetamide
CID 78829398
N-ethyl-2-[ethyl-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]amino]acetamide
CID 9433463

Frequently Asked Questions

What is the IUPAC name of 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide?
The IUPAC name of 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide (CID 8683962) is 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide.
What is the SMILES notation for 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide?
The canonical SMILES for 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide is CCNC(=O)CN(CC)Cc1cc(OC)ccc1OC.
What is the InChIKey of 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide?
The InChIKey is SDOMQXVPUJHHEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-5-16-15(18)11-17(6-2)10-12-9-13(19-3)7-8-14(12)20-4/h7-9H,5-6,10-11H2,1-4H3,(H,16,18).
What are the key properties of 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide?
2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide has a molecular weight of 280.37 g/mol, XLogP of 1.66, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,5-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide is sourced from PubChem (CID 8683962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).