2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide

C15H24N2O2 — CID 54930613

IUPAC2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide
SMILESCC(N)Cc1ccc(OCC(=O)NC(C)(C)C)cc1
InChIInChI=1S/C15H24N2O2/c1-11(16)9-12-5-7-13(8-6-12)19-10-14(18)17-15(2,3)4/h5-8,11H,9-10,16H2,1-4H3,(H,17,18)
InChIKeySSOFUZYANPIPNY-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.87
Rot. Bonds5

About 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide

2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide (PubChem CID 54930613) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide.

Molecular Properties

Compound Name2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide
PubChem CID54930613
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide
SMILESCC(N)Cc1ccc(OCC(=O)NC(C)(C)C)cc1
InChIInChI=1S/C15H24N2O2/c1-11(16)9-12-5-7-13(8-6-12)19-10-14(18)17-15(2,3)4/h5-8,11H,9-10,16H2,1-4H3,(H,17,18)
InChIKeySSOFUZYANPIPNY-UHFFFAOYSA-N
XLogP1.87
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-(4-ethylphenoxy)acetamide
CID 807221
2-[4-(2-aminopropyl)phenoxy]-N-prop-2-enylacetamide
CID 54930522
methyl 2-[4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]acetate
CID 47096345
2-[3-(2-aminopropyl)phenoxy]-N-(2-methylbutan-2-yl)acetamide
CID 61486419
4-[[4-[2-(tert-butylamino)-2-oxoethoxy]phenyl]methylamino]benzoic acid
CID 66525531
N-tert-butyl-2-[4-[(4-fluoroanilino)methyl]phenoxy]acetamide
CID 66525538
2-[4-(aminomethyl)phenoxy]-N-(2-cyano-3-methylbutan-2-yl)acetamide
CID 106484798
N-tert-butyl-2-[4-[(3-propan-2-yloxypropylamino)methyl]phenoxy]acetamide
CID 17208957
N-tert-butyl-2-[4-[[3-(ethylamino)propylamino]methyl]phenoxy]acetamide
CID 17215562
N-tert-butyl-2-[4-[[2-(2-hydroxyethylamino)ethylamino]methyl]phenoxy]acetamide;dihydrochloride
CID 17295535
N-tert-butyl-2-[4-[[3-(ethylamino)propylamino]methyl]phenoxy]acetamide;dihydrochloride
CID 17215561
N-(1-amino-2-methylpropan-2-yl)-2-(4-ethylphenoxy)acetamide
CID 82354507

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide?
The IUPAC name of 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide (CID 54930613) is 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide.
What is the SMILES notation for 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide?
The canonical SMILES for 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide is CC(N)Cc1ccc(OCC(=O)NC(C)(C)C)cc1.
What is the InChIKey of 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide?
The InChIKey is SSOFUZYANPIPNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(16)9-12-5-7-13(8-6-12)19-10-14(18)17-15(2,3)4/h5-8,11H,9-10,16H2,1-4H3,(H,17,18).
What are the key properties of 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide?
2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide has a molecular weight of 264.37 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminopropyl)phenoxy]-N-tert-butylacetamide is sourced from PubChem (CID 54930613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).