(2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide

C13H20N2O — CID 103794882

IUPAC(2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)N(C)c1cccc(C)c1
InChIInChI=1S/C13H20N2O/c1-4-6-12(14)13(16)15(3)11-8-5-7-10(2)9-11/h5,7-9,12H,4,6,14H2,1-3H3/t12-/m1/s1
InChIKeyDWFNUXABIJGBFF-GFCCVEGCSA-N
MW220.32 g/mol
LogP2.09
Rot. Bonds4

About (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide

(2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide (PubChem CID 103794882) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide
PubChem CID103794882
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name(2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide
SMILESCCC[C@@H](N)C(=O)N(C)c1cccc(C)c1
InChIInChI=1S/C13H20N2O/c1-4-6-12(14)13(16)15(3)11-8-5-7-10(2)9-11/h5,7-9,12H,4,6,14H2,1-3H3/t12-/m1/s1
InChIKeyDWFNUXABIJGBFF-GFCCVEGCSA-N
XLogP2.09
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(3,5-dimethylphenyl)-N-methylpentanamide
CID 103628440
(2S)-2-amino-N-methyl-N-(3-methylphenyl)-4-methylsulfanylbutanamide;hydrochloride
CID 119280854
2-amino-N-methyl-N-(3-methylphenyl)-2-phenylacetamide
CID 76931148
(2S)-2-amino-N-(3-methoxyphenyl)-N-methylhexanamide
CID 107145312
(2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide
CID 107570953
(2S)-2-amino-N-(3-hydroxyphenyl)-N-methylbutanamide
CID 107734784
methyl 2-amino-4-(N,3-dimethylanilino)butanoate
CID 63053473
2-amino-N-methyl-N-(3-methylphenyl)acetamide
CID 28794377
(2S)-2-amino-N-ethyl-3-methyl-N-(3-methylphenyl)butanamide
CID 22690792
2-amino-N-ethyl-5-methoxy-N-(3-methylphenyl)pentanamide
CID 81088935
4-amino-3-methoxy-N-methyl-N-(3-methylphenyl)butanamide
CID 103155733
2-amino-N-(2,4-dimethylphenyl)-N-methylhexanamide
CID 113227828

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide?
The IUPAC name of (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide (CID 103794882) is (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide is CCC[C@@H](N)C(=O)N(C)c1cccc(C)c1.
What is the InChIKey of (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide?
The InChIKey is DWFNUXABIJGBFF-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-6-12(14)13(16)15(3)11-8-5-7-10(2)9-11/h5,7-9,12H,4,6,14H2,1-3H3/t12-/m1/s1.
What are the key properties of (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide?
(2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide has a molecular weight of 220.32 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide is sourced from PubChem (CID 103794882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).