(2R)-2-amino-N-(3-ethylphenyl)pentanamide

C13H20N2O — CID 103793845

IUPAC(2R)-2-amino-N-(3-ethylphenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1cccc(CC)c1
InChIInChI=1S/C13H20N2O/c1-3-6-12(14)13(16)15-11-8-5-7-10(4-2)9-11/h5,7-9,12H,3-4,6,14H2,1-2H3,(H,15,16)/t12-/m1/s1
InChIKeyZGUROSWMRPXKPH-GFCCVEGCSA-N
MW220.32 g/mol
LogP2.31
Rot. Bonds5

About (2R)-2-amino-N-(3-ethylphenyl)pentanamide

(2R)-2-amino-N-(3-ethylphenyl)pentanamide (PubChem CID 103793845) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is (2R)-2-amino-N-(3-ethylphenyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(3-ethylphenyl)pentanamide
PubChem CID103793845
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name(2R)-2-amino-N-(3-ethylphenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1cccc(CC)c1
InChIInChI=1S/C13H20N2O/c1-3-6-12(14)13(16)15-11-8-5-7-10(4-2)9-11/h5,7-9,12H,3-4,6,14H2,1-2H3,(H,15,16)/t12-/m1/s1
InChIKeyZGUROSWMRPXKPH-GFCCVEGCSA-N
XLogP2.31
TPSA55.12 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 ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(3-ethylphenyl)pentanamide;hydrochloride
CID 119263935
(2S)-2-amino-N-[3-(hydroxymethyl)phenyl]pentanamide
CID 107568565
2-amino-N-(3-ethylphenyl)butanediamide
CID 54928255
2-amino-N-[3-(carbamoylamino)phenyl]pentanamide
CID 43710986
2-amino-N-[3-(3,3,3-trifluoropropyl)phenyl]pentanamide
CID 119343981
2-amino-N-[3-(tert-butylsulfinylmethyl)phenyl]pentanamide
CID 119327254
2-amino-N-(3-propan-2-ylphenyl)pentanamide
CID 43650216
2-[3-[[(2S)-2-aminohexanoyl]amino]phenyl]acetic acid
CID 107145776
2-amino-N-[3-(2-phenylethoxymethyl)phenyl]pentanamide;hydrochloride
CID 119306590
3-[[(2R)-2-aminopentanoyl]amino]-N-ethylbenzamide
CID 103794052
6-amino-N-(3-ethylphenyl)-2-methylheptanamide
CID 65293048
2-amino-N-(3-nitrophenyl)pentanamide
CID 113223757

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(3-ethylphenyl)pentanamide?
The IUPAC name of (2R)-2-amino-N-(3-ethylphenyl)pentanamide (CID 103793845) is (2R)-2-amino-N-(3-ethylphenyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-(3-ethylphenyl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-(3-ethylphenyl)pentanamide is CCC[C@@H](N)C(=O)Nc1cccc(CC)c1.
What is the InChIKey of (2R)-2-amino-N-(3-ethylphenyl)pentanamide?
The InChIKey is ZGUROSWMRPXKPH-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H20N2O/c1-3-6-12(14)13(16)15-11-8-5-7-10(4-2)9-11/h5,7-9,12H,3-4,6,14H2,1-2H3,(H,15,16)/t12-/m1/s1.
What are the key properties of (2R)-2-amino-N-(3-ethylphenyl)pentanamide?
(2R)-2-amino-N-(3-ethylphenyl)pentanamide has a molecular weight of 220.32 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(3-ethylphenyl)pentanamide is sourced from PubChem (CID 103793845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).