N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide

C19H21NO2 — CID 110790434

IUPACN-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCCc1ccc2c(c1)CCCO2
InChIInChI=1S/C19H21NO2/c21-19(14-15-5-2-1-3-6-15)20-11-10-16-8-9-18-17(13-16)7-4-12-22-18/h1-3,5-6,8-9,13H,4,7,10-12,14H2,(H,20,21)
InChIKeyAYVAEUWCOONNCE-UHFFFAOYSA-N
MW295.38 g/mol
LogP2.91
Rot. Bonds5

About N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide

N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide (PubChem CID 110790434) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide
PubChem CID110790434
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC NameN-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCCc1ccc2c(c1)CCCO2
InChIInChI=1S/C19H21NO2/c21-19(14-15-5-2-1-3-6-15)20-11-10-16-8-9-18-17(13-16)7-4-12-22-18/h1-3,5-6,8-9,13H,4,7,10-12,14H2,(H,20,21)
InChIKeyAYVAEUWCOONNCE-UHFFFAOYSA-N
XLogP2.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]butanamide
CID 110790414
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2-(4-methylphenyl)acetamide
CID 110792404
2-(3,4-dihydro-2H-chromen-6-yl)ethylurea
CID 115168538
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2-(3-methylphenyl)acetamide
CID 110792403
2-(3,4-dihydro-2H-chromen-6-yl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 110771131
2-(1,3-benzodioxol-5-yl)-N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]acetamide
CID 122136652
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2-thiophen-3-ylacetamide
CID 119041803
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-phenoxypropanamide
CID 110792383
3-chloro-N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]propanamide
CID 115162653
N-[2-(3-chlorophenyl)ethyl]-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide
CID 110767505
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(2-methoxyphenyl)propanamide
CID 110792398
methyl 4-[2-[[2-(2,3-dihydro-1-benzofuran-5-yl)acetyl]amino]ethyl]benzoate
CID 51075520

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide?
The IUPAC name of N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide (CID 110790434) is N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide is O=C(Cc1ccccc1)NCCc1ccc2c(c1)CCCO2.
What is the InChIKey of N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide?
The InChIKey is AYVAEUWCOONNCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c21-19(14-15-5-2-1-3-6-15)20-11-10-16-8-9-18-17(13-16)7-4-12-22-18/h1-3,5-6,8-9,13H,4,7,10-12,14H2,(H,20,21).
What are the key properties of N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide?
N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide has a molecular weight of 295.38 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,4-dihydro-2H-chromen-6-yl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 110790434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).