(2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide

C11H16N2O — CID 101024424

IUPAC(2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide
SMILESCc1cccc(C[C@@](C)(N)C(N)=O)c1
InChIInChI=1S/C11H16N2O/c1-8-4-3-5-9(6-8)7-11(2,13)10(12)14/h3-6H,7,13H2,1-2H3,(H2,12,14)/t11-/m1/s1
InChIKeyWOECQUMNUQAGLJ-LLVKDONJSA-N
MW192.26 g/mol
LogP0.74
Rot. Bonds3

About (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide

(2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide (PubChem CID 101024424) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide
PubChem CID101024424
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name(2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide
SMILESCc1cccc(C[C@@](C)(N)C(N)=O)c1
InChIInChI=1S/C11H16N2O/c1-8-4-3-5-9(6-8)7-11(2,13)10(12)14/h3-6H,7,13H2,1-2H3,(H2,12,14)/t11-/m1/s1
InChIKeyWOECQUMNUQAGLJ-LLVKDONJSA-N
XLogP0.74
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-2-methyl-3-(3-methylphenyl)propanoic acid
CID 83639747
2-methyl-2-[(3-methylphenyl)methyl]propane-1,3-diol
CID 79001727
diethyl 2-ethyl-2-[(3-methylphenyl)methyl]propanedioate
CID 103972968
5-amino-5-methyl-1-(3-methylphenyl)hexan-2-one
CID 116571386
(3-methylphenyl)methylurea
CID 60776531
2,3-dimethyl-1-(3-methylphenyl)butan-2-ol
CID 60798225
1,2-bis(3-methylphenyl)propan-2-ol
CID 60798209
3-amino-3-ethyl-1-(3-methylphenyl)pentan-2-one
CID 116592724
2-amino-3-(3-hydroxyphenyl)-2-methylpropanoic acid;hydrate
CID 2729001
butanamide;propane;1,3-xylene
CID 153379124
2,2-dimethylpropane;1-(2,2-dimethylpropyl)-3-methylbenzene;ethane;propane
CID 144517677
1-(2,2-dimethylbut-3-ynyl)-3-methylbenzene
CID 122240116

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide?
The IUPAC name of (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide (CID 101024424) is (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide.
What is the SMILES notation for (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide?
The canonical SMILES for (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide is Cc1cccc(C[C@@](C)(N)C(N)=O)c1.
What is the InChIKey of (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide?
The InChIKey is WOECQUMNUQAGLJ-LLVKDONJSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8-4-3-5-9(6-8)7-11(2,13)10(12)14/h3-6H,7,13H2,1-2H3,(H2,12,14)/t11-/m1/s1.
What are the key properties of (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide?
(2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide has a molecular weight of 192.26 g/mol, XLogP of 0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-methyl-3-(3-methylphenyl)propanamide is sourced from PubChem (CID 101024424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).