(2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide

C12H18N2O — CID 10608375

IUPAC(2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide
SMILESCCNC(=O)[C@@H](Cc1ccccc1)NC
InChIInChI=1S/C12H18N2O/c1-3-14-12(15)11(13-2)9-10-7-5-4-6-8-10/h4-8,11,13H,3,9H2,1-2H3,(H,14,15)/t11-/m1/s1
InChIKeyAGRGSNZZYPMIHJ-LLVKDONJSA-N
MW206.29 g/mol
LogP0.95
Rot. Bonds5

About (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide

(2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide (PubChem CID 10608375) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide
PubChem CID10608375
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name(2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide
SMILESCCNC(=O)[C@@H](Cc1ccccc1)NC
InChIInChI=1S/C12H18N2O/c1-3-14-12(15)11(13-2)9-10-7-5-4-6-8-10/h4-8,11,13H,3,9H2,1-2H3,(H,14,15)/t11-/m1/s1
InChIKeyAGRGSNZZYPMIHJ-LLVKDONJSA-N
XLogP0.95
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(methylamino)-N-[2-(methylamino)ethyl]-3-phenylpropanamide
CID 100959272
(2S)-2-(methylamino)-3-phenylpropanoic acid
CID 6951135
N-ethyl-2-methyl-3-phenylpropanamide
CID 58846627
2-(methylamino)-N-[6-(methylamino)hexyl]-3-phenylpropanamide
CID 172626022
2-[[2-[[(2S)-2-(methylamino)-3-phenylpropanoyl]amino]acetyl]amino]acetic acid
CID 70669722
(2S)-N-ethyl-2-[[2-[[2-(methylamino)acetyl]amino]acetyl]amino]-3-phenylpropanamide
CID 135192567
N-ethyl-2-hydroxy-3-phenylpropanamide
CID 13215108
(3R)-3-(methylamino)-4-phenylbutan-2-one
CID 59965984
2-[[2-(methylamino)-3-phenylpropanoyl]amino]butanamide
CID 174410015
2-amino-N-[1-(ethylamino)-1-oxo-3-phenylpropan-2-yl]-3,3-dimethylbutanamide
CID 21062343
(2R)-2-[(4-chlorophenyl)sulfonylamino]-N-ethyl-3-phenylpropanamide
CID 41374224
2-amino-N-ethyl-3-phenylpropanamide;hydrochloride
CID 53409094

Frequently Asked Questions

What is the IUPAC name of (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide?
The IUPAC name of (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide (CID 10608375) is (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide.
What is the SMILES notation for (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide?
The canonical SMILES for (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide is CCNC(=O)[C@@H](Cc1ccccc1)NC.
What is the InChIKey of (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide?
The InChIKey is AGRGSNZZYPMIHJ-LLVKDONJSA-N. The full InChI is InChI=1S/C12H18N2O/c1-3-14-12(15)11(13-2)9-10-7-5-4-6-8-10/h4-8,11,13H,3,9H2,1-2H3,(H,14,15)/t11-/m1/s1.
What are the key properties of (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide?
(2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide has a molecular weight of 206.29 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-ethyl-2-(methylamino)-3-phenylpropanamide is sourced from PubChem (CID 10608375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).