3-amino-3-(4-methoxyphenyl)-2-methylpropanamide

C11H16N2O2 — CID 67167673

IUPAC3-amino-3-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(N)C(C)C(N)=O)cc1
InChIInChI=1S/C11H16N2O2/c1-7(11(13)14)10(12)8-3-5-9(15-2)6-4-8/h3-7,10H,12H2,1-2H3,(H2,13,14)
InChIKeyABIQYTJURHECJC-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.82
Rot. Bonds4

About 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide

3-amino-3-(4-methoxyphenyl)-2-methylpropanamide (PubChem CID 67167673) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound Name3-amino-3-(4-methoxyphenyl)-2-methylpropanamide
PubChem CID67167673
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name3-amino-3-(4-methoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(C(N)C(C)C(N)=O)cc1
InChIInChI=1S/C11H16N2O2/c1-7(11(13)14)10(12)8-3-5-9(15-2)6-4-8/h3-7,10H,12H2,1-2H3,(H2,13,14)
InChIKeyABIQYTJURHECJC-UHFFFAOYSA-N
XLogP0.82
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-2-(4-methoxyphenyl)acetamide
CID 14569003
(2S)-2-amino-2-(4-methoxyphenyl)acetamide
CID 54341108
methyl (2R,3S)-2,3-diamino-3-(4-methoxyphenyl)propanoate
CID 135055623
(2R,3S)-3-amino-1-(4-methoxyphenyl)-2-methyl-3-phenylpropan-1-one
CID 10635675
2-[1-amino-1-(4-methoxyphenyl)propan-2-yl]sulfanylacetamide
CID 114231462
1-(4-methoxyphenyl)-2-N,2-N-dimethylpropane-1,2-diamine
CID 16781513
3-amino-N-[1-(4-methoxyphenyl)ethyl]-2-methyl-3-phenylpropanamide;hydrochloride
CID 119706532
(1S,2S)-2-amino-1,2-bis(4-methoxyphenyl)ethanol
CID 90478708
(1R,2S)-2-amino-1,2-bis(4-methoxyphenyl)ethanol
CID 10707410
(1R)-1-(4-methoxyphenyl)-2-methylbutan-1-amine
CID 171200898
3-amino-N-[1-(4-methoxyphenyl)propyl]-2-methyl-3-phenylpropanamide
CID 119689348
(1S,2R)-1-(4-methoxyphenyl)-2-N-methylpropane-1,2-diamine
CID 163535290

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide?
The IUPAC name of 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide (CID 67167673) is 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide?
The canonical SMILES for 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide is COc1ccc(C(N)C(C)C(N)=O)cc1.
What is the InChIKey of 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide?
The InChIKey is ABIQYTJURHECJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-7(11(13)14)10(12)8-3-5-9(15-2)6-4-8/h3-7,10H,12H2,1-2H3,(H2,13,14).
What are the key properties of 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide?
3-amino-3-(4-methoxyphenyl)-2-methylpropanamide has a molecular weight of 208.26 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-(4-methoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 67167673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).