2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide

C12H18N2O3 — CID 43278556

IUPAC2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide
SMILESCNCc1ccc(OC(C)C(N)=O)c(OC)c1
InChIInChI=1S/C12H18N2O3/c1-8(12(13)15)17-10-5-4-9(7-14-2)6-11(10)16-3/h4-6,8,14H,7H2,1-3H3,(H2,13,15)
InChIKeyUOSXSBGOBTVXED-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.67
Rot. Bonds6

About 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide

2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide (PubChem CID 43278556) has the molecular formula C12H18N2O3 and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide.

Molecular Properties

Compound Name2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide
PubChem CID43278556
Molecular FormulaC12H18N2O3
Molecular Weight238.29 g/mol
Exact Mass238.13
IUPAC Name2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide
SMILESCNCc1ccc(OC(C)C(N)=O)c(OC)c1
InChIInChI=1S/C12H18N2O3/c1-8(12(13)15)17-10-5-4-9(7-14-2)6-11(10)16-3/h4-6,8,14H,7H2,1-3H3,(H2,13,15)
InChIKeyUOSXSBGOBTVXED-UHFFFAOYSA-N
XLogP0.67
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-methoxy-4-[(2-methoxyethylamino)methyl]phenoxy]propanamide
CID 63055739
ethyl 2-[2-methoxy-5-(methylaminomethyl)phenoxy]butanoate
CID 64669906
2-[5-(2-aminoethyl)-2-methoxyphenoxy]propanamide
CID 54930549
2-[4-[(tert-butylamino)methyl]-2-methoxyphenoxy]-N-methylpropanamide
CID 63057094
2-[2-methoxy-5-(methylaminomethyl)phenoxy]-N-propan-2-ylacetamide
CID 43278726
2-[2-methoxy-4-(propylaminomethyl)phenoxy]butanamide
CID 62899820
2-[2-methoxy-5-(propylaminomethyl)phenoxy]-N-methylpropanamide
CID 43278792
methyl 2-[2-methoxy-4-(methylaminomethyl)phenoxy]acetate
CID 60882991
1-[2-methoxy-4-(methylaminomethyl)phenoxy]propan-2-ol
CID 60881863
2-[(3,4-dimethoxyphenyl)methylamino]-N-methylpropanamide
CID 43400841
1-(3,4-dimethoxyphenyl)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]methanamine
CID 30611503
N-ethyl-2-[2-methoxy-4-[(propan-2-ylamino)methyl]phenoxy]propanamide
CID 43278651

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide?
The IUPAC name of 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide (CID 43278556) is 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide.
What is the SMILES notation for 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide?
The canonical SMILES for 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide is CNCc1ccc(OC(C)C(N)=O)c(OC)c1.
What is the InChIKey of 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide?
The InChIKey is UOSXSBGOBTVXED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3/c1-8(12(13)15)17-10-5-4-9(7-14-2)6-11(10)16-3/h4-6,8,14H,7H2,1-3H3,(H2,13,15).
What are the key properties of 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide?
2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide has a molecular weight of 238.29 g/mol, XLogP of 0.67, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-4-(methylaminomethyl)phenoxy]propanamide is sourced from PubChem (CID 43278556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).