(2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide

C18H19NO3 — CID 99117467

IUPAC(2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide
SMILESCO[C@@H](C(=O)N[C@@H]1CCc2c(O)cccc21)c1ccccc1
InChIInChI=1S/C18H19NO3/c1-22-17(12-6-3-2-4-7-12)18(21)19-15-11-10-14-13(15)8-5-9-16(14)20/h2-9,15,17,20H,10-11H2,1H3,(H,19,21)/t15-,17-/m1/s1
InChIKeyFHUROMYURHMQAB-NVXWUHKLSA-N
MW297.35 g/mol
LogP2.88
Rot. Bonds4

About (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide

(2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide (PubChem CID 99117467) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide
PubChem CID99117467
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC Name(2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide
SMILESCO[C@@H](C(=O)N[C@@H]1CCc2c(O)cccc21)c1ccccc1
InChIInChI=1S/C18H19NO3/c1-22-17(12-6-3-2-4-7-12)18(21)19-15-11-10-14-13(15)8-5-9-16(14)20/h2-9,15,17,20H,10-11H2,1H3,(H,19,21)/t15-,17-/m1/s1
InChIKeyFHUROMYURHMQAB-NVXWUHKLSA-N
XLogP2.88
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxy-2,3-dihydro-1H-inden-1-yl)-2-phenoxy-2-phenylacetamide
CID 86949742
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CID 958449
(2R)-N-cyclohexyl-2-methoxy-2-phenylacetamide
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N-(4-hydroxy-2,3-dihydro-1H-inden-1-yl)-2-pyridin-2-ylsulfanylpropanamide
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(2S)-N-[(1R)-cyclohex-2-en-1-yl]-2-methoxy-2-phenylacetamide
CID 10060436
(2S)-2-amino-N-(4-methoxy-2,3-dihydro-1H-inden-1-yl)propanamide
CID 119317459
N-(4-hydroxy-2,3-dihydro-1H-inden-1-yl)-3-methoxy-4-phenylmethoxybenzamide
CID 86886993
methyl 3-[(4-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]propanoate
CID 43637145
N-[2-[[(1S)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-2-oxoethyl]-2-phenylacetamide
CID 95146524
2,6-difluoro-N-[(1S)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]benzamide
CID 95934372
ethyl (3S)-3-hydroxy-4-[[(1R)-5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-4-oxobutanoate
CID 124729299
(2R)-N-cyclopentyl-2-[[(2S)-2-methoxy-2-phenylacetyl]amino]propanamide
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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide?
The IUPAC name of (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide (CID 99117467) is (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide.
What is the SMILES notation for (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide?
The canonical SMILES for (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide is CO[C@@H](C(=O)N[C@@H]1CCc2c(O)cccc21)c1ccccc1.
What is the InChIKey of (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide?
The InChIKey is FHUROMYURHMQAB-NVXWUHKLSA-N. The full InChI is InChI=1S/C18H19NO3/c1-22-17(12-6-3-2-4-7-12)18(21)19-15-11-10-14-13(15)8-5-9-16(14)20/h2-9,15,17,20H,10-11H2,1H3,(H,19,21)/t15-,17-/m1/s1.
What are the key properties of (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide?
(2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide has a molecular weight of 297.35 g/mol, XLogP of 2.88, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1R)-4-hydroxy-2,3-dihydro-1H-inden-1-yl]-2-methoxy-2-phenylacetamide is sourced from PubChem (CID 99117467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).