N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide

C12H18N2O2 — CID 104872813

IUPACN-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)N[C@H](C)CN)cc1
InChIInChI=1S/C12H18N2O2/c1-9(8-13)14-12(15)7-10-3-5-11(16-2)6-4-10/h3-6,9H,7-8,13H2,1-2H3,(H,14,15)/t9-/m1/s1
InChIKeyAINYWRTZJXFZFR-SECBINFHSA-N
MW222.29 g/mol
LogP0.70
Rot. Bonds5

About N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide

N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide (PubChem CID 104872813) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide
PubChem CID104872813
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC NameN-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)N[C@H](C)CN)cc1
InChIInChI=1S/C12H18N2O2/c1-9(8-13)14-12(15)7-10-3-5-11(16-2)6-4-10/h3-6,9H,7-8,13H2,1-2H3,(H,14,15)/t9-/m1/s1
InChIKeyAINYWRTZJXFZFR-SECBINFHSA-N
XLogP0.70
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminopropan-2-yl)-2-(4-methoxyphenoxy)acetamide
CID 110834177
N-(1-bromopropan-2-yl)-2-(4-methoxyphenyl)acetamide
CID 114310520
2-(4-methoxyphenyl)-N-propan-2-ylacetamide
CID 813075
N-[(2S)-1-aminopropan-2-yl]-2-(4-fluorophenyl)acetamide;hydrochloride
CID 120506260
2-amino-N-[4-(4-methoxyphenyl)butan-2-yl]acetamide
CID 119288095
(2S)-2-[[2-(4-methoxyphenyl)acetyl]amino]propanoic acid
CID 42254545
2-(4-methoxyphenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 94843836
N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-(4-methoxyphenyl)acetamide
CID 39819173
N-[(2R)-1-(4-methoxyphenoxy)propan-2-yl]-2-(4-methylphenyl)acetamide
CID 92680005
N-(4-aminobutan-2-yl)-3-(4-methoxyphenyl)propanamide
CID 62093484
2-(4-ethylphenyl)-N-[(2R)-1-(4-methoxyphenoxy)propan-2-yl]acetamide
CID 100589508
2-(4-chlorophenyl)-N-[1-(4-methoxyphenoxy)propan-2-yl]acetamide
CID 132651656

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide (CID 104872813) is N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide is COc1ccc(CC(=O)N[C@H](C)CN)cc1.
What is the InChIKey of N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide?
The InChIKey is AINYWRTZJXFZFR-SECBINFHSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9(8-13)14-12(15)7-10-3-5-11(16-2)6-4-10/h3-6,9H,7-8,13H2,1-2H3,(H,14,15)/t9-/m1/s1.
What are the key properties of N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide?
N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide has a molecular weight of 222.29 g/mol, XLogP of 0.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-aminopropan-2-yl]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 104872813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).