N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide

C14H22N2O2 — CID 110833199

IUPACN-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide
SMILESCCOc1ccccc1CCC(=O)NC(C)CN
InChIInChI=1S/C14H22N2O2/c1-3-18-13-7-5-4-6-12(13)8-9-14(17)16-11(2)10-15/h4-7,11H,3,8-10,15H2,1-2H3,(H,16,17)
InChIKeyOYFMIZBLGVLDBZ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.48
Rot. Bonds7

About N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide

N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide (PubChem CID 110833199) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide
PubChem CID110833199
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide
SMILESCCOc1ccccc1CCC(=O)NC(C)CN
InChIInChI=1S/C14H22N2O2/c1-3-18-13-7-5-4-6-12(13)8-9-14(17)16-11(2)10-15/h4-7,11H,3,8-10,15H2,1-2H3,(H,16,17)
InChIKeyOYFMIZBLGVLDBZ-UHFFFAOYSA-N
XLogP1.48
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-1-aminopropan-2-yl]-4-(2-ethoxyphenoxy)butanamide
CID 120507806
N-(1-aminopropan-2-yl)-3-(2-fluorophenyl)propanamide
CID 110833187
N-(1-aminopropan-2-yl)-3-(2-chlorophenyl)propanamide
CID 110833172
2-[3-(2-ethoxyphenyl)propanoylamino]-3-hydroxypropanoic acid
CID 43171627
3-(2-ethoxyphenyl)-N-[1-(4-ethylphenyl)ethyl]propanamide
CID 134049400
3-(2-ethoxyphenyl)-N-[(2S)-2-hydroxypropyl]propanamide
CID 83029751
2-cyclopropyl-2-[3-(2-ethoxyphenyl)propanoylamino]acetic acid
CID 62696875
[2-oxo-2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]ethyl] 3-(2-ethoxyphenyl)propanoate
CID 8648612
3-(2-ethoxyphenyl)-N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]propanamide
CID 9264272
N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-3-(2-ethoxyphenyl)propanamide
CID 55388712
3-[3-(2-ethoxyphenyl)propanoylamino]propanoic acid
CID 43170647
methyl 2-[3-(2-ethoxyphenyl)propanoylamino]acetate
CID 43406380

Frequently Asked Questions

What is the IUPAC name of N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide?
The IUPAC name of N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide (CID 110833199) is N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide.
What is the SMILES notation for N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide?
The canonical SMILES for N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide is CCOc1ccccc1CCC(=O)NC(C)CN.
What is the InChIKey of N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide?
The InChIKey is OYFMIZBLGVLDBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-18-13-7-5-4-6-12(13)8-9-14(17)16-11(2)10-15/h4-7,11H,3,8-10,15H2,1-2H3,(H,16,17).
What are the key properties of N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide?
N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide has a molecular weight of 250.34 g/mol, XLogP of 1.48, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminopropan-2-yl)-3-(2-ethoxyphenyl)propanamide is sourced from PubChem (CID 110833199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).