N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide

C19H19N3O3 — CID 111119852

IUPACN-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide
SMILESCc1ccccc1C(O)CNC(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C19H19N3O3/c1-13-6-2-3-7-14(13)17(23)10-21-18(24)12-22-16-9-5-4-8-15(16)20-11-19(22)25/h2-9,11,17,23H,10,12H2,1H3,(H,21,24)
InChIKeyFPEFUSIEQCJMLU-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.55
Rot. Bonds5

About N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide

N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide (PubChem CID 111119852) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide
PubChem CID111119852
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide
SMILESCc1ccccc1C(O)CNC(=O)Cn1c(=O)cnc2ccccc21
InChIInChI=1S/C19H19N3O3/c1-13-6-2-3-7-14(13)17(23)10-21-18(24)12-22-16-9-5-4-8-15(16)20-11-19(22)25/h2-9,11,17,23H,10,12H2,1H3,(H,21,24)
InChIKeyFPEFUSIEQCJMLU-UHFFFAOYSA-N
XLogP1.55
TPSA84.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-ethyl-2-hydroxypentyl)-2-(2-oxoquinoxalin-1-yl)acetamide
CID 111115882
N-[(2S,4R)-4-hydroxy-2-phenylpentyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 97019470
2-(2-oxoquinoxalin-1-yl)-N-pentylacetamide
CID 31482684
2-(2-oxoquinoxalin-1-yl)-N-(2-propan-2-ylphenyl)acetamide
CID 8023093
N-[1-(2-bromophenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 16548369
2-(2-oxoquinoxalin-1-yl)-N-[4-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]phenyl]acetamide
CID 166181883
methyl 6-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]hexanoate
CID 31838969
2-(2-oxoquinoxalin-1-yl)-N-phenylacetamide
CID 4805436
N-[(2R)-1-methoxypropan-2-yl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 2509253
N,N-dimethyl-4-[[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]methyl]benzamide
CID 134039211
methyl 4-[[2-(2-oxoquinoxalin-1-yl)acetyl]amino]benzoate
CID 26098218
N-(2-benzylphenyl)-2-(2-oxoquinoxalin-1-yl)acetamide
CID 2469352

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide?
The IUPAC name of N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide (CID 111119852) is N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide.
What is the SMILES notation for N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide?
The canonical SMILES for N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide is Cc1ccccc1C(O)CNC(=O)Cn1c(=O)cnc2ccccc21.
What is the InChIKey of N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide?
The InChIKey is FPEFUSIEQCJMLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-13-6-2-3-7-14(13)17(23)10-21-18(24)12-22-16-9-5-4-8-15(16)20-11-19(22)25/h2-9,11,17,23H,10,12H2,1H3,(H,21,24).
What are the key properties of N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide?
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide has a molecular weight of 337.38 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-2-(2-methylphenyl)ethyl]-2-(2-oxoquinoxalin-1-yl)acetamide is sourced from PubChem (CID 111119852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).