(2R)-2-amino-2-benzyl-4-methylpentanamide

C13H20N2O — CID 66678418

IUPAC(2R)-2-amino-2-benzyl-4-methylpentanamide
SMILESCC(C)C[C@@](N)(Cc1ccccc1)C(N)=O
InChIInChI=1S/C13H20N2O/c1-10(2)8-13(15,12(14)16)9-11-6-4-3-5-7-11/h3-7,10H,8-9,15H2,1-2H3,(H2,14,16)/t13-/m1/s1
InChIKeyQMVXXHFBTIVYQE-CYBMUJFWSA-N
MW220.32 g/mol
LogP1.46
Rot. Bonds5

About (2R)-2-amino-2-benzyl-4-methylpentanamide

(2R)-2-amino-2-benzyl-4-methylpentanamide (PubChem CID 66678418) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is (2R)-2-amino-2-benzyl-4-methylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-2-benzyl-4-methylpentanamide
PubChem CID66678418
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name(2R)-2-amino-2-benzyl-4-methylpentanamide
SMILESCC(C)C[C@@](N)(Cc1ccccc1)C(N)=O
InChIInChI=1S/C13H20N2O/c1-10(2)8-13(15,12(14)16)9-11-6-4-3-5-7-11/h3-7,10H,8-9,15H2,1-2H3,(H2,14,16)/t13-/m1/s1
InChIKeyQMVXXHFBTIVYQE-CYBMUJFWSA-N
XLogP1.46
TPSA69.11 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 ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-benzylhexanamide
CID 174812463
(2R)-2-amino-2-benzylpent-4-enamide
CID 135080853
(2R)-2-benzyl-2,4-dimethylpentanoyl chloride
CID 146469685
(2R)-2-amino-2-methyl-3-phenylpropanoic acid
CID 7023409
methyl 2-amino-2-benzyl-3-phenylpropanoate
CID 10825855
(2R)-2-amino-2-(aminomethyl)-3-phenylpropanoic acid
CID 91046027
(2R)-2-hydroxy-2-methyl-3-phenylpropanamide
CID 11389739
(2R)-2,3-diamino-2-benzyl-3-oxopropanoic acid
CID 62705603
2-amino-2-benzylpentanoic acid
CID 24974249
(E,3S)-3-amino-3-benzylhept-5-en-2-one
CID 90145324
2-methyl-3-phenyl-2-propan-2-yloxypropanamide
CID 142432674
(2R)-2-amino-2,4,4-trimethyl-1-phenylpentan-3-one
CID 177194439

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-benzyl-4-methylpentanamide?
The IUPAC name of (2R)-2-amino-2-benzyl-4-methylpentanamide (CID 66678418) is (2R)-2-amino-2-benzyl-4-methylpentanamide.
What is the SMILES notation for (2R)-2-amino-2-benzyl-4-methylpentanamide?
The canonical SMILES for (2R)-2-amino-2-benzyl-4-methylpentanamide is CC(C)C[C@@](N)(Cc1ccccc1)C(N)=O.
What is the InChIKey of (2R)-2-amino-2-benzyl-4-methylpentanamide?
The InChIKey is QMVXXHFBTIVYQE-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10(2)8-13(15,12(14)16)9-11-6-4-3-5-7-11/h3-7,10H,8-9,15H2,1-2H3,(H2,14,16)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-2-benzyl-4-methylpentanamide?
(2R)-2-amino-2-benzyl-4-methylpentanamide has a molecular weight of 220.32 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-benzyl-4-methylpentanamide is sourced from PubChem (CID 66678418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).