N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide

C24H23NO3 — CID 46421464

IUPACN-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NC1CCOc2ccccc21
InChIInChI=1S/C24H23NO3/c1-17(24(26)25-22-15-16-27-23-10-6-5-9-21(22)23)28-20-13-11-19(12-14-20)18-7-3-2-4-8-18/h2-14,17,22H,15-16H2,1H3,(H,25,26)
InChIKeyGDEDXTPIVJJPSP-UHFFFAOYSA-N
MW373.45 g/mol
LogP4.76
Rot. Bonds5

About N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide

N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide (PubChem CID 46421464) has the molecular formula C24H23NO3 and a molecular weight of 373.45 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide
PubChem CID46421464
Molecular FormulaC24H23NO3
Molecular Weight373.45 g/mol
Exact Mass373.17
IUPAC NameN-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide
SMILESCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NC1CCOc2ccccc21
InChIInChI=1S/C24H23NO3/c1-17(24(26)25-22-15-16-27-23-10-6-5-9-21(22)23)28-20-13-11-19(12-14-20)18-7-3-2-4-8-18/h2-14,17,22H,15-16H2,1H3,(H,25,26)
InChIKeyGDEDXTPIVJJPSP-UHFFFAOYSA-N
XLogP4.76
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.45
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-cyclopentyl-2-(4-phenylphenoxy)propanamide
CID 7868566
2-(4-bromophenoxy)-N-(6-chloro-3,4-dihydro-2H-chromen-4-yl)propanamide
CID 108742340
N-(3,4-dihydro-2H-chromen-4-yl)-2-(2,2,2-trifluoroethoxy)propanamide
CID 43077858
[1-(3,4-dihydro-2H-chromen-4-ylamino)-1-oxopropan-2-yl] 4-prop-2-enoxybenzoate
CID 55569612
(2S)-2-bromo-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-methylbutanamide
CID 93300423
(2S)-2-bromo-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-3-methylbutanamide
CID 93300419
2-bromo-N-(3,4-dihydro-2H-chromen-4-yl)-3-methylbutanamide
CID 43244721
2-acetamido-N-(3,4-dihydro-2H-chromen-4-yl)-3-methylbutanamide
CID 18115199
(2S)-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-methylsulfonylpropanamide
CID 94025535
[1-(3,4-dihydro-2H-chromen-4-ylamino)-1-oxopropan-2-yl] 2-naphthalen-2-ylacetate
CID 55526216
N-(2,2-dimethyl-3,4-dihydrochromen-4-yl)-2-phenoxypropanamide
CID 132651020
(2R)-2-amino-N-(3,4-dihydro-2H-chromen-4-yl)-2-phenylacetamide
CID 61180627

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide (CID 46421464) is N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide is CC(Oc1ccc(-c2ccccc2)cc1)C(=O)NC1CCOc2ccccc21.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide?
The InChIKey is GDEDXTPIVJJPSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO3/c1-17(24(26)25-22-15-16-27-23-10-6-5-9-21(22)23)28-20-13-11-19(12-14-20)18-7-3-2-4-8-18/h2-14,17,22H,15-16H2,1H3,(H,25,26).
What are the key properties of N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide?
N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide has a molecular weight of 373.45 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-4-yl)-2-(4-phenylphenoxy)propanamide is sourced from PubChem (CID 46421464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).