(2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid

C10H11NO3 — CID 93297974

IUPAC(2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid
SMILESN[C@@H](C(=O)O)c1ccc2c(c1)CCO2
InChIInChI=1S/C10H11NO3/c11-9(10(12)13)7-1-2-8-6(5-7)3-4-14-8/h1-2,5,9H,3-4,11H2,(H,12,13)/t9-/m1/s1
InChIKeyUGGLSCFXJWMUNI-SECBINFHSA-N
MW193.20 g/mol
LogP0.71
Rot. Bonds2

About (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid

(2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid (PubChem CID 93297974) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid.

Molecular Properties

Compound Name(2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid
PubChem CID93297974
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name(2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid
SMILESN[C@@H](C(=O)O)c1ccc2c(c1)CCO2
InChIInChI=1S/C10H11NO3/c11-9(10(12)13)7-1-2-8-6(5-7)3-4-14-8/h1-2,5,9H,3-4,11H2,(H,12,13)/t9-/m1/s1
InChIKeyUGGLSCFXJWMUNI-SECBINFHSA-N
XLogP0.71
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid
CID 66510589
2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)-1-pyrrolidin-1-ylethanone
CID 116851344
2-amino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid
CID 4625672
2-(2,3-dihydro-1-benzofuran-5-yl)-2-hydroxyacetamide
CID 62225836
(4R)-4-amino-4-(2,3-dihydro-1-benzofuran-5-yl)butanoic acid
CID 28744449
4-amino-4-(2,3-dihydro-1-benzofuran-5-yl)butanoic acid
CID 43209176
2-acetyloxy-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid
CID 23335826
3-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)-2-methylpropanoic acid
CID 116908097
(2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)ethanol
CID 66513598
2-amino-3-(2,3-dihydro-1-benzofuran-5-yl)-3-oxopropanoic acid
CID 116920551
6-amino-6-(2,3-dihydro-1-benzofuran-5-yl)hexanamide
CID 54927378
(2S)-2-amino-3-(2,3-dihydro-1-benzofuran-5-yl)propanoic acid
CID 62717626

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid?
The IUPAC name of (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid (CID 93297974) is (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid.
What is the SMILES notation for (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid?
The canonical SMILES for (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid is N[C@@H](C(=O)O)c1ccc2c(c1)CCO2.
What is the InChIKey of (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid?
The InChIKey is UGGLSCFXJWMUNI-SECBINFHSA-N. The full InChI is InChI=1S/C10H11NO3/c11-9(10(12)13)7-1-2-8-6(5-7)3-4-14-8/h1-2,5,9H,3-4,11H2,(H,12,13)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid?
(2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid has a molecular weight of 193.20 g/mol, XLogP of 0.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)acetic acid is sourced from PubChem (CID 93297974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).