(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide

C15H24N2O3 — CID 8845701

IUPAC(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide
SMILESCCNC(=O)[C@@H](C)N(C)Cc1ccc(OC)cc1OC
InChIInChI=1S/C15H24N2O3/c1-6-16-15(18)11(2)17(3)10-12-7-8-13(19-4)9-14(12)20-5/h7-9,11H,6,10H2,1-5H3,(H,16,18)/t11-/m1/s1
InChIKeyRTRRXUBONNZUPD-LLVKDONJSA-N
MW280.37 g/mol
LogP1.66
Rot. Bonds7

About (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide

(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide (PubChem CID 8845701) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide.

Molecular Properties

Compound Name(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide
PubChem CID8845701
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide
SMILESCCNC(=O)[C@@H](C)N(C)Cc1ccc(OC)cc1OC
InChIInChI=1S/C15H24N2O3/c1-6-16-15(18)11(2)17(3)10-12-7-8-13(19-4)9-14(12)20-5/h7-9,11H,6,10H2,1-5H3,(H,16,18)/t11-/m1/s1
InChIKeyRTRRXUBONNZUPD-LLVKDONJSA-N
XLogP1.66
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
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

(2R)-N-(2,5-dichlorophenyl)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]propanamide
CID 2689350
2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-(2-methylcyclohexyl)propanamide
CID 47005760
N-[(2,4-dimethoxyphenyl)methyl]-2-hydroxy-N-methylpropanamide
CID 115140783
1-[(2,4-dimethoxyphenyl)methyl]-3-ethylurea
CID 47277960
2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N,2-diphenylacetamide
CID 55471442
N-[2-(2,4-dimethoxyphenyl)ethyl]-2-ethylbutanamide
CID 110408765
(2,4-dimethoxyphenyl)methyl-methylcarbamic acid
CID 115170960
2-[2-(aminomethyl)-5-methoxyphenoxy]-N-ethylpropanamide
CID 61269246
N-[(2,4-dimethoxyphenyl)methyl]-2,4-dimethoxy-N-methylbenzamide
CID 18111734
N-[(2,4-dimethoxyphenyl)methyl]-2-(ethylamino)-N-methylacetamide
CID 115157957
(2R)-2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N-ethylpropanamide
CID 8681988
(2S)-2-[(2-methoxyphenyl)methyl-methylamino]-N-prop-2-enylpropanamide
CID 94015388

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide?
The IUPAC name of (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide (CID 8845701) is (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide.
What is the SMILES notation for (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide?
The canonical SMILES for (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide is CCNC(=O)[C@@H](C)N(C)Cc1ccc(OC)cc1OC.
What is the InChIKey of (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide?
The InChIKey is RTRRXUBONNZUPD-LLVKDONJSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-6-16-15(18)11(2)17(3)10-12-7-8-13(19-4)9-14(12)20-5/h7-9,11H,6,10H2,1-5H3,(H,16,18)/t11-/m1/s1.
What are the key properties of (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide?
(2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide has a molecular weight of 280.37 g/mol, XLogP of 1.66, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2,4-dimethoxyphenyl)methyl-methylamino]-N-ethylpropanamide is sourced from PubChem (CID 8845701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).