(2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide

C17H15N3O2 — CID 135832723

IUPAC(2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide
SMILESO=C(N/N=C/c1cc2ccccc2[nH]1)[C@H](O)c1ccccc1
InChIInChI=1S/C17H15N3O2/c21-16(12-6-2-1-3-7-12)17(22)20-18-11-14-10-13-8-4-5-9-15(13)19-14/h1-11,16,19,21H,(H,20,22)/b18-11+/t16-/m1/s1
InChIKeyOEJILXNQFAVAPJ-YCPFAOKUSA-N
MW293.33 g/mol
LogP2.35
Rot. Bonds4

About (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide

(2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide (PubChem CID 135832723) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide
PubChem CID135832723
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name(2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide
SMILESO=C(N/N=C/c1cc2ccccc2[nH]1)[C@H](O)c1ccccc1
InChIInChI=1S/C17H15N3O2/c21-16(12-6-2-1-3-7-12)17(22)20-18-11-14-10-13-8-4-5-9-15(13)19-14/h1-11,16,19,21H,(H,20,22)/b18-11+/t16-/m1/s1
InChIKeyOEJILXNQFAVAPJ-YCPFAOKUSA-N
XLogP2.35
TPSA77.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[(Z)-anthracen-9-ylmethylideneamino]-2-hydroxy-2-phenylacetamide
CID 5435830
(2R)-2-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-phenylacetamide
CID 135674788
N-[(3,4-dihydroxyphenyl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 4618895
(2R)-2-hydroxy-N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-2-phenylacetamide
CID 135832660
(2R)-N-[(3-bromophenyl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 905815
(2R)-N-[(Z)-(2,4-dimethylphenyl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 5414506
(2R)-2-hydroxy-N-[(Z)-(4-methoxyphenyl)methylideneamino]-2-phenylacetamide
CID 40516770
N-(2-hydroxyphenyl)-N'-[(E)-1H-indol-2-ylmethylideneamino]heptanediamide
CID 135875953
(2S)-N-[(4,5-dibromofuran-2-yl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 1034854
(2S)-2-hydroxy-N-[(Z)-(6-methyl-2-pyridinyl)methylideneamino]-2-phenylacetamide
CID 94849044
(2S)-N-[(Z)-(5-bromo-2,4-dimethoxyphenyl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 126270849
N-[(5-bromo-2-hydroxy-3-iodophenyl)methylideneamino]-2-hydroxy-2-phenylacetamide
CID 2853257

Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide?
The IUPAC name of (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide (CID 135832723) is (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide?
The canonical SMILES for (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide is O=C(N/N=C/c1cc2ccccc2[nH]1)[C@H](O)c1ccccc1.
What is the InChIKey of (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide?
The InChIKey is OEJILXNQFAVAPJ-YCPFAOKUSA-N. The full InChI is InChI=1S/C17H15N3O2/c21-16(12-6-2-1-3-7-12)17(22)20-18-11-14-10-13-8-4-5-9-15(13)19-14/h1-11,16,19,21H,(H,20,22)/b18-11+/t16-/m1/s1.
What are the key properties of (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide?
(2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide has a molecular weight of 293.33 g/mol, XLogP of 2.35, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-N-[(E)-1H-indol-2-ylmethylideneamino]-2-phenylacetamide is sourced from PubChem (CID 135832723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).