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

C14H22N2O3 — CID 43276391

IUPAC2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide
SMILESCCCNCc1cc(OC)ccc1OC(C)C(N)=O
InChIInChI=1S/C14H22N2O3/c1-4-7-16-9-11-8-12(18-3)5-6-13(11)19-10(2)14(15)17/h5-6,8,10,16H,4,7,9H2,1-3H3,(H2,15,17)
InChIKeyZASGUOKLEDHRAP-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.45
Rot. Bonds8

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

2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide (PubChem CID 43276391) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide.

Molecular Properties

Compound Name2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide
PubChem CID43276391
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide
SMILESCCCNCc1cc(OC)ccc1OC(C)C(N)=O
InChIInChI=1S/C14H22N2O3/c1-4-7-16-9-11-8-12(18-3)5-6-13(11)19-10(2)14(15)17/h5-6,8,10,16H,4,7,9H2,1-3H3,(H2,15,17)
InChIKeyZASGUOKLEDHRAP-UHFFFAOYSA-N
XLogP1.45
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-aminoethyl)-4-methoxyphenoxy]propanamide
CID 54931370
methyl 2-[4-methoxy-2-[(2-methylpropylamino)methyl]phenoxy]propanoate
CID 63062325
2-[5-methoxy-2-(propylaminomethyl)phenoxy]butanamide
CID 62901536
2-[4-methoxy-2-[(propan-2-ylamino)methyl]phenoxy]butanamide
CID 62899630
2-[4-methoxy-2-(propylaminomethyl)phenoxy]-N-propylacetamide
CID 43276397
2-[2-(aminomethyl)-5-methoxyphenoxy]propanamide
CID 61269245
2-[4-chloro-2-(propylaminomethyl)phenoxy]-N-propylpropanamide
CID 43277990
N-ethyl-2-[4-methoxy-2-(methylaminomethyl)phenoxy]propanamide
CID 43276266
N-ethyl-2-[4-methoxy-2-(propylaminomethyl)phenoxy]-N-methylacetamide
CID 43309412
1-[4-methoxy-2-(propylaminomethyl)phenoxy]-2-methylpropan-2-ol
CID 60880225
N-[[5-methoxy-2-(2-methylprop-2-enoxy)phenyl]methyl]propan-1-amine
CID 60880606
2-[2-(aminomethyl)-4-methoxyphenoxy]-N-pentan-3-ylpropanamide
CID 43268118

Frequently Asked Questions

What is the IUPAC name of 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide?
The IUPAC name of 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide (CID 43276391) is 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide.
What is the SMILES notation for 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide?
The canonical SMILES for 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide is CCCNCc1cc(OC)ccc1OC(C)C(N)=O.
What is the InChIKey of 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide?
The InChIKey is ZASGUOKLEDHRAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-4-7-16-9-11-8-12(18-3)5-6-13(11)19-10(2)14(15)17/h5-6,8,10,16H,4,7,9H2,1-3H3,(H2,15,17).
What are the key properties of 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide?
2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide has a molecular weight of 266.34 g/mol, XLogP of 1.45, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methoxy-2-(propylaminomethyl)phenoxy]propanamide is sourced from PubChem (CID 43276391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).