N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide

C16H26N2O2 — CID 43279683

IUPACN-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide
SMILESCCCNC(=O)COc1ccccc1C(C)NCCC
InChIInChI=1S/C16H26N2O2/c1-4-10-17-13(3)14-8-6-7-9-15(14)20-12-16(19)18-11-5-2/h6-9,13,17H,4-5,10-12H2,1-3H3,(H,18,19)
InChIKeyOUKJQSLNIFGLON-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.65
Rot. Bonds9

About N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide

N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide (PubChem CID 43279683) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide.

Molecular Properties

Compound NameN-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide
PubChem CID43279683
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide
SMILESCCCNC(=O)COc1ccccc1C(C)NCCC
InChIInChI=1S/C16H26N2O2/c1-4-10-17-13(3)14-8-6-7-9-15(14)20-12-16(19)18-11-5-2/h6-9,13,17H,4-5,10-12H2,1-3H3,(H,18,19)
InChIKeyOUKJQSLNIFGLON-UHFFFAOYSA-N
XLogP2.65
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(1-hydroxyethyl)phenoxy]-N-propylacetamide
CID 43503995
2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]-N-propylacetamide
CID 63640126
N-[1-[2-(2-chloroprop-2-enoxy)phenyl]ethyl]propan-1-amine
CID 60882886
2-(2-propan-2-ylphenoxy)-N-[8-[[2-(2-propan-2-ylphenoxy)acetyl]amino]octyl]acetamide
CID 17233327
2-[4-bromo-2-[1-(propylamino)ethyl]phenoxy]-N-ethylacetamide
CID 62393036
2-[5-fluoro-2-[1-(propylamino)ethyl]phenoxy]-N-prop-2-ynylacetamide
CID 63066740
N-[2-[1-(2-ethoxyphenyl)ethylamino]ethyl]-2-methylpropanamide
CID 43203001
N-(2-aminoethyl)-2-(2-butan-2-ylphenoxy)acetamide
CID 61207891
N-ethyl-2-[2-(1-hydroxyethyl)phenoxy]acetamide
CID 43504037
2-[2-(1-hydroxyethyl)phenoxy]-N-(3-methylbutyl)acetamide
CID 61486616
2-[2-[(1R)-1-hydroxyethyl]phenoxy]-N-(3-methylbutyl)acetamide
CID 63364835
N-(cyanomethyl)-2-[5-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide
CID 63640138

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide?
The IUPAC name of N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide (CID 43279683) is N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide.
What is the SMILES notation for N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide?
The canonical SMILES for N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide is CCCNC(=O)COc1ccccc1C(C)NCCC.
What is the InChIKey of N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide?
The InChIKey is OUKJQSLNIFGLON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-4-10-17-13(3)14-8-6-7-9-15(14)20-12-16(19)18-11-5-2/h6-9,13,17H,4-5,10-12H2,1-3H3,(H,18,19).
What are the key properties of N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide?
N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide has a molecular weight of 278.40 g/mol, XLogP of 2.65, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-[2-[1-(propylamino)ethyl]phenoxy]acetamide is sourced from PubChem (CID 43279683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).