N,N-diethyl-2H-pyran-4-carboxamide

C10H15NO2 — CID 57247371

IUPACN,N-diethyl-2H-pyran-4-carboxamide
SMILESCCN(CC)C(=O)C1=CCOC=C1
InChIInChI=1S/C10H15NO2/c1-3-11(4-2)10(12)9-5-7-13-8-6-9/h5-7H,3-4,8H2,1-2H3
InChIKeyOGIHVWMOYXLNIF-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.33
Rot. Bonds3

About N,N-diethyl-2H-pyran-4-carboxamide

N,N-diethyl-2H-pyran-4-carboxamide (PubChem CID 57247371) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N,N-diethyl-2H-pyran-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2H-pyran-4-carboxamide
PubChem CID57247371
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN,N-diethyl-2H-pyran-4-carboxamide
SMILESCCN(CC)C(=O)C1=CCOC=C1
InChIInChI=1S/C10H15NO2/c1-3-11(4-2)10(12)9-5-7-13-8-6-9/h5-7H,3-4,8H2,1-2H3
InChIKeyOGIHVWMOYXLNIF-UHFFFAOYSA-N
XLogP1.33
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2H-pyran-4-carboxamide?
The IUPAC name of N,N-diethyl-2H-pyran-4-carboxamide (CID 57247371) is N,N-diethyl-2H-pyran-4-carboxamide.
What is the SMILES notation for N,N-diethyl-2H-pyran-4-carboxamide?
The canonical SMILES for N,N-diethyl-2H-pyran-4-carboxamide is CCN(CC)C(=O)C1=CCOC=C1.
What is the InChIKey of N,N-diethyl-2H-pyran-4-carboxamide?
The InChIKey is OGIHVWMOYXLNIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-3-11(4-2)10(12)9-5-7-13-8-6-9/h5-7H,3-4,8H2,1-2H3.
What are the key properties of N,N-diethyl-2H-pyran-4-carboxamide?
N,N-diethyl-2H-pyran-4-carboxamide has a molecular weight of 181.23 g/mol, XLogP of 1.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2H-pyran-4-carboxamide is sourced from PubChem (CID 57247371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).