(4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol

C11H15NO2 — CID 130699791

IUPAC(4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol
SMILESCCc1c(O)ccc2c1[C@H](N)CCO2
InChIInChI=1S/C11H15NO2/c1-2-7-9(13)3-4-10-11(7)8(12)5-6-14-10/h3-4,8,13H,2,5-6,12H2,1H3/t8-/m1/s1
InChIKeyLVROTYVPKKHTNE-MRVPVSSYSA-N
MW193.25 g/mol
LogP1.74
Rot. Bonds1

About (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol

(4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol (PubChem CID 130699791) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol.

Molecular Properties

Compound Name(4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol
PubChem CID130699791
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name(4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol
SMILESCCc1c(O)ccc2c1[C@H](N)CCO2
InChIInChI=1S/C11H15NO2/c1-2-7-9(13)3-4-10-11(7)8(12)5-6-14-10/h3-4,8,13H,2,5-6,12H2,1H3/t8-/m1/s1
InChIKeyLVROTYVPKKHTNE-MRVPVSSYSA-N
XLogP1.74
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4S)-4-amino-5-fluoro-3,4-dihydro-2H-chromen-6-ol
CID 130611343
(4R)-4-amino-5-iodo-3,4-dihydro-2H-chromen-6-ol
CID 131076126
(4S)-4-amino-6-methoxy-3,4-dihydro-2H-chromen-5-ol
CID 130642446
(4S)-6-ethyl-3,4-dihydro-2H-chromen-4-amine;hydrochloride
CID 75412144
(4S)-4-amino-5-methoxy-3,4-dihydro-2H-chromen-8-ol
CID 130706327
(4R)-6-fluoro-5-iodo-3,4-dihydro-2H-chromen-4-amine
CID 130779709
7-ethyl-3,4-dihydro-2H-chromen-4-amine
CID 55294378
(4R)-8-ethyl-3,4-dihydro-2H-chromene-4,5-diamine
CID 131081672
(5S)-5-amino-4-ethyl-5,6,7,8-tetrahydronaphthalen-1-ol
CID 131096656
(4S)-5-bromo-8-ethyl-3,4-dihydro-2H-chromen-4-amine
CID 130673857
(4S)-8-ethyl-7-iodo-3,4-dihydro-2H-chromen-4-amine
CID 130609322
(3R)-3-amino-4-methoxy-2,3-dihydro-1-benzofuran-5-ol
CID 130665432

Frequently Asked Questions

What is the IUPAC name of (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol?
The IUPAC name of (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol (CID 130699791) is (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol.
What is the SMILES notation for (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol?
The canonical SMILES for (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol is CCc1c(O)ccc2c1[C@H](N)CCO2.
What is the InChIKey of (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol?
The InChIKey is LVROTYVPKKHTNE-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-2-7-9(13)3-4-10-11(7)8(12)5-6-14-10/h3-4,8,13H,2,5-6,12H2,1H3/t8-/m1/s1.
What are the key properties of (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol?
(4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol has a molecular weight of 193.25 g/mol, XLogP of 1.74, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-amino-5-ethyl-3,4-dihydro-2H-chromen-6-ol is sourced from PubChem (CID 130699791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).