N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide

C8H13NO2 — CID 126997661

IUPACN-ethyl-3,6-dihydro-2H-pyran-4-carboxamide
SMILESCCNC(=O)C1=CCOCC1
InChIInChI=1S/C8H13NO2/c1-2-9-8(10)7-3-5-11-6-4-7/h3H,2,4-6H2,1H3,(H,9,10)
InChIKeyFFURATLSKUGUAK-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.47
Rot. Bonds2

About N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide

N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide (PubChem CID 126997661) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-3,6-dihydro-2H-pyran-4-carboxamide
PubChem CID126997661
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC NameN-ethyl-3,6-dihydro-2H-pyran-4-carboxamide
SMILESCCNC(=O)C1=CCOCC1
InChIInChI=1S/C8H13NO2/c1-2-9-8(10)7-3-5-11-6-4-7/h3H,2,4-6H2,1H3,(H,9,10)
InChIKeyFFURATLSKUGUAK-UHFFFAOYSA-N
XLogP0.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide?
The IUPAC name of N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide (CID 126997661) is N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide.
What is the SMILES notation for N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide?
The canonical SMILES for N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide is CCNC(=O)C1=CCOCC1.
What is the InChIKey of N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide?
The InChIKey is FFURATLSKUGUAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-2-9-8(10)7-3-5-11-6-4-7/h3H,2,4-6H2,1H3,(H,9,10).
What are the key properties of N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide?
N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide has a molecular weight of 155.20 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,6-dihydro-2H-pyran-4-carboxamide is sourced from PubChem (CID 126997661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).