N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide

C13H20N2O — CID 78952919

IUPACN-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide
SMILESCCNC(=O)C(C)N[C@H](C)c1ccccc1
InChIInChI=1S/C13H20N2O/c1-4-14-13(16)11(3)15-10(2)12-8-6-5-7-9-12/h5-11,15H,4H2,1-3H3,(H,14,16)/t10-,11?/m1/s1
InChIKeyAHZOMBYWUFDUOA-NFJWQWPMSA-N
MW220.32 g/mol
LogP1.86
Rot. Bonds5

About N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide

N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide (PubChem CID 78952919) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide.

Molecular Properties

Compound NameN-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide
PubChem CID78952919
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide
SMILESCCNC(=O)C(C)N[C@H](C)c1ccccc1
InChIInChI=1S/C13H20N2O/c1-4-14-13(16)11(3)15-10(2)12-8-6-5-7-9-12/h5-11,15H,4H2,1-3H3,(H,14,16)/t10-,11?/m1/s1
InChIKeyAHZOMBYWUFDUOA-NFJWQWPMSA-N
XLogP1.86
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylpropyl)-2-[[(1S)-1-phenylethyl]amino]propanamide
CID 63705951
2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-N-ethylpropanamide
CID 81360050
2-[[1-(ethylamino)-1-oxopropan-2-yl]amino]-2-phenylacetic acid
CID 55036307
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-N-ethylpropanamide
CID 81352154
N-ethyl-2-[[(1S)-1-(3-methylphenyl)ethyl]amino]propanamide
CID 81361243
(2S)-N-ethyl-2-[[(1R)-1-phenylethyl]carbamoylamino]propanamide
CID 36515448
N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide
CID 63866912
N-pentan-2-yl-2-[[(1R)-1-phenylethyl]amino]propanamide
CID 78948251
2-[1-(3,5-dimethylphenyl)ethylamino]-N-ethylpropanamide
CID 81301009
N-(2-methylbutan-2-yl)-2-(1-phenylethylamino)propanamide
CID 43113751
N-ethyl-2-(1-pyridin-2-ylethylamino)propanamide
CID 43396710
2-(1-phenylethylamino)propanoic acid;hydrochloride
CID 75479950

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide?
The IUPAC name of N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide (CID 78952919) is N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide.
What is the SMILES notation for N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide?
The canonical SMILES for N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide is CCNC(=O)C(C)N[C@H](C)c1ccccc1.
What is the InChIKey of N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide?
The InChIKey is AHZOMBYWUFDUOA-NFJWQWPMSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-14-13(16)11(3)15-10(2)12-8-6-5-7-9-12/h5-11,15H,4H2,1-3H3,(H,14,16)/t10-,11?/m1/s1.
What are the key properties of N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide?
N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide has a molecular weight of 220.32 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide is sourced from PubChem (CID 78952919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).