2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide

C16H19NO2 — CID 9159559

IUPAC2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide
SMILESO=C(C[C@@H]1C=CCC1)N[C@@H]1CCOc2ccccc21
InChIInChI=1S/C16H19NO2/c18-16(11-12-5-1-2-6-12)17-14-9-10-19-15-8-4-3-7-13(14)15/h1,3-5,7-8,12,14H,2,6,9-11H2,(H,17,18)/t12-,14-/m1/s1
InChIKeyYNGXZBXNXVNMKC-TZMCWYRMSA-N
MW257.33 g/mol
LogP2.98
Rot. Bonds3

About 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide

2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide (PubChem CID 9159559) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide.

Molecular Properties

Compound Name2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide
PubChem CID9159559
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide
SMILESO=C(C[C@@H]1C=CCC1)N[C@@H]1CCOc2ccccc21
InChIInChI=1S/C16H19NO2/c18-16(11-12-5-1-2-6-12)17-14-9-10-19-15-8-4-3-7-13(14)15/h1,3-5,7-8,12,14H,2,6,9-11H2,(H,17,18)/t12-,14-/m1/s1
InChIKeyYNGXZBXNXVNMKC-TZMCWYRMSA-N
XLogP2.98
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[(1R)-cyclopent-2-en-1-yl]-N-[(5R)-2,3,4,5-tetrahydro-1-benzoxepin-5-yl]acetamide
CID 95278359
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CID 95278358
3-amino-N-(3,4-dihydro-2H-chromen-4-yl)propanamide;hydrochloride
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N-(3,4-dihydro-2H-chromen-4-yl)-2-(prop-2-enylamino)acetamide
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N-(3,4-dihydro-2H-chromen-4-yl)-2-naphthalen-1-ylacetamide
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N-(3,4-dihydro-2H-chromen-4-yl)-2-morpholin-2-ylacetamide;hydrochloride
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N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetamide
CID 9159657
2-benzylsulfanyl-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
CID 18164391
2-(1-adamantyl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
CID 18192975
N-(3,4-dihydro-2H-chromen-4-yl)-3-(2-fluorophenyl)sulfanylpropanamide
CID 18096155

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide?
The IUPAC name of 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide (CID 9159559) is 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide.
What is the SMILES notation for 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide?
The canonical SMILES for 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide is O=C(C[C@@H]1C=CCC1)N[C@@H]1CCOc2ccccc21.
What is the InChIKey of 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide?
The InChIKey is YNGXZBXNXVNMKC-TZMCWYRMSA-N. The full InChI is InChI=1S/C16H19NO2/c18-16(11-12-5-1-2-6-12)17-14-9-10-19-15-8-4-3-7-13(14)15/h1,3-5,7-8,12,14H,2,6,9-11H2,(H,17,18)/t12-,14-/m1/s1.
What are the key properties of 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide?
2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide has a molecular weight of 257.33 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-cyclopent-2-en-1-yl]-N-[(4R)-3,4-dihydro-2H-chromen-4-yl]acetamide is sourced from PubChem (CID 9159559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).