(2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide

C12H18N2O — CID 78979225

IUPAC(2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide
SMILESCCN(C(=O)[C@@H](C)N)c1ccc(C)cc1
InChIInChI=1S/C12H18N2O/c1-4-14(12(15)10(3)13)11-7-5-9(2)6-8-11/h5-8,10H,4,13H2,1-3H3/t10-/m1/s1
InChIKeyASUXQMHKLMDAHJ-SNVBAGLBSA-N
MW206.29 g/mol
LogP1.70
Rot. Bonds3

About (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide

(2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide (PubChem CID 78979225) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide
PubChem CID78979225
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name(2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide
SMILESCCN(C(=O)[C@@H](C)N)c1ccc(C)cc1
InChIInChI=1S/C12H18N2O/c1-4-14(12(15)10(3)13)11-7-5-9(2)6-8-11/h5-8,10H,4,13H2,1-3H3/t10-/m1/s1
InChIKeyASUXQMHKLMDAHJ-SNVBAGLBSA-N
XLogP1.70
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-methyl-N-(4-methylphenyl)propanamide
CID 60737044
(2S)-2-amino-N-ethyl-N-(4-fluorophenyl)propanamide;hydrochloride
CID 119271831
(2R)-2-amino-N-ethyl-N-pyridin-4-ylpropanamide
CID 106935605
4-amino-N-ethyl-2-methyl-N-(4-methylphenyl)butanamide
CID 80543945
2-cyano-N-ethyl-N-(4-methylphenyl)propanamide
CID 55207914
2-amino-N-[[4-[cyclopropyl(ethyl)amino]phenyl]methyl]-N-(4-methylphenyl)propanamide
CID 143695976
3-amino-N-ethyl-N-(4-methylphenyl)-2-phenylpropanamide
CID 62876984
ethane;N-ethyl-N-(4-methylphenyl)acetamide
CID 143607666
2-(N-[(2S)-2-amino-3-methylpentanoyl]-4-methylanilino)acetic acid
CID 15615026
N-ethyl-2-hydroxy-2-(4-methylphenyl)-N-phenylacetamide
CID 82134297
2-[N-(2-aminobutanoyl)-4-methylanilino]acetic acid
CID 61161641
2-[[ethyl-(4-methylphenyl)carbamoyl]-propan-2-ylamino]acetic acid
CID 62003076

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide?
The IUPAC name of (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide (CID 78979225) is (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide?
The canonical SMILES for (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide is CCN(C(=O)[C@@H](C)N)c1ccc(C)cc1.
What is the InChIKey of (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide?
The InChIKey is ASUXQMHKLMDAHJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H18N2O/c1-4-14(12(15)10(3)13)11-7-5-9(2)6-8-11/h5-8,10H,4,13H2,1-3H3/t10-/m1/s1.
What are the key properties of (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide?
(2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide has a molecular weight of 206.29 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-ethyl-N-(4-methylphenyl)propanamide is sourced from PubChem (CID 78979225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).