N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide

C21H19NO2 — CID 18115215

IUPACN-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide
SMILESO=C(Cc1cccc2ccccc12)NC1CCOc2ccccc21
InChIInChI=1S/C21H19NO2/c23-21(14-16-8-5-7-15-6-1-2-9-17(15)16)22-19-12-13-24-20-11-4-3-10-18(19)20/h1-11,19H,12-14H2,(H,22,23)
InChIKeyQVRPBWWICDSRQB-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.02
Rot. Bonds3

About N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide

N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide (PubChem CID 18115215) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide
PubChem CID18115215
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC NameN-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide
SMILESO=C(Cc1cccc2ccccc12)NC1CCOc2ccccc21
InChIInChI=1S/C21H19NO2/c23-21(14-16-8-5-7-15-6-1-2-9-17(15)16)22-19-12-13-24-20-11-4-3-10-18(19)20/h1-11,19H,12-14H2,(H,22,23)
InChIKeyQVRPBWWICDSRQB-UHFFFAOYSA-N
XLogP4.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(3,4-dihydro-2H-chromen-4-yl)propanamide;hydrochloride
CID 119268905
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-naphthalen-2-ylsulfanylacetamide
CID 30803635
5-(3,4-dihydro-2H-chromen-4-ylamino)-5-oxopentanoic acid
CID 43580055
4-chloro-N-(3,4-dihydro-2H-chromen-4-yl)butanamide
CID 63309102
N-cyclopropyl-2-naphthalen-1-ylacetamide
CID 976036
1-(3,4-dihydro-2H-chromen-4-yl)-3-[(2-fluorophenyl)methyl]urea
CID 110866066
2-benzylsulfanyl-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
CID 18164391
N-(3,4-dihydro-2H-chromen-4-yl)-2-(prop-2-enylamino)acetamide
CID 78912235
2-(1-adamantyl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
CID 18192975
2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide
CID 9159559
N-[(4R)-8-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-2-naphthalen-1-ylacetamide
CID 25401650
2-bromo-N-(2,3,4,5-tetrahydro-1-benzoxepin-5-yl)acetamide
CID 19694270

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide?
The IUPAC name of N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide (CID 18115215) is N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide is O=C(Cc1cccc2ccccc12)NC1CCOc2ccccc21.
What is the InChIKey of N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide?
The InChIKey is QVRPBWWICDSRQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c23-21(14-16-8-5-7-15-6-1-2-9-17(15)16)22-19-12-13-24-20-11-4-3-10-18(19)20/h1-11,19H,12-14H2,(H,22,23).
What are the key properties of N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide?
N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide has a molecular weight of 317.39 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 18115215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).