(2R)-2-(3-aminophenoxy)-N-methylpropanamide

C10H14N2O2 — CID 28908554

IUPAC(2R)-2-(3-aminophenoxy)-N-methylpropanamide
SMILESCNC(=O)[C@@H](C)Oc1cccc(N)c1
InChIInChI=1S/C10H14N2O2/c1-7(10(13)12-2)14-9-5-3-4-8(11)6-9/h3-7H,11H2,1-2H3,(H,12,13)/t7-/m1/s1
InChIKeyBQJXWCMPBHCEIJ-SSDOTTSWSA-N
MW194.23 g/mol
LogP0.78
Rot. Bonds3

About (2R)-2-(3-aminophenoxy)-N-methylpropanamide

(2R)-2-(3-aminophenoxy)-N-methylpropanamide (PubChem CID 28908554) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (2R)-2-(3-aminophenoxy)-N-methylpropanamide.

Molecular Properties

Compound Name(2R)-2-(3-aminophenoxy)-N-methylpropanamide
PubChem CID28908554
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(2R)-2-(3-aminophenoxy)-N-methylpropanamide
SMILESCNC(=O)[C@@H](C)Oc1cccc(N)c1
InChIInChI=1S/C10H14N2O2/c1-7(10(13)12-2)14-9-5-3-4-8(11)6-9/h3-7H,11H2,1-2H3,(H,12,13)/t7-/m1/s1
InChIKeyBQJXWCMPBHCEIJ-SSDOTTSWSA-N
XLogP0.78
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(3-aminophenoxy)propanamide
CID 43115971
2-[3-(1-aminoethyl)phenoxy]-N-methylpropanamide
CID 43116403
N-methyl-2-phenoxypropanamide
CID 4626974
(2R)-2-(3-aminophenoxy)-N-prop-2-enylpropanamide
CID 93455625
2-(3-aminophenoxy)-N-(2-chlorophenyl)propanamide
CID 82027601
2-(3-cyanophenoxy)-N-methylpropanamide
CID 43085589
2-(3-aminophenoxy)-N-(2-ethyl-6-methylphenyl)propanamide
CID 82027609
(2R)-N-methyl-2-naphthalen-2-yloxypropanamide
CID 42561231
2-(3-aminophenoxy)-1-(4-methylphenyl)propan-1-one
CID 46307478
(2S)-N-(3,5-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 2168120
N-(4-aminophenyl)-2-(3-propan-2-ylphenoxy)propanamide
CID 16794467
2-[3-(3-aminophenoxy)propanoylamino]-N-methylpropanamide
CID 61464065

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-aminophenoxy)-N-methylpropanamide?
The IUPAC name of (2R)-2-(3-aminophenoxy)-N-methylpropanamide (CID 28908554) is (2R)-2-(3-aminophenoxy)-N-methylpropanamide.
What is the SMILES notation for (2R)-2-(3-aminophenoxy)-N-methylpropanamide?
The canonical SMILES for (2R)-2-(3-aminophenoxy)-N-methylpropanamide is CNC(=O)[C@@H](C)Oc1cccc(N)c1.
What is the InChIKey of (2R)-2-(3-aminophenoxy)-N-methylpropanamide?
The InChIKey is BQJXWCMPBHCEIJ-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-7(10(13)12-2)14-9-5-3-4-8(11)6-9/h3-7H,11H2,1-2H3,(H,12,13)/t7-/m1/s1.
What are the key properties of (2R)-2-(3-aminophenoxy)-N-methylpropanamide?
(2R)-2-(3-aminophenoxy)-N-methylpropanamide has a molecular weight of 194.23 g/mol, XLogP of 0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-aminophenoxy)-N-methylpropanamide is sourced from PubChem (CID 28908554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).