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

C7H11NO2 — CID 131175874

IUPACN-methyl-3,6-dihydro-2H-pyran-4-carboxamide
SMILESCNC(=O)C1=CCOCC1
InChIInChI=1S/C7H11NO2/c1-8-7(9)6-2-4-10-5-3-6/h2H,3-5H2,1H3,(H,8,9)
InChIKeyPAPHMAFWDWPSAI-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.08
Rot. Bonds1

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

N-methyl-3,6-dihydro-2H-pyran-4-carboxamide (PubChem CID 131175874) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is N-methyl-3,6-dihydro-2H-pyran-4-carboxamide.

Molecular Properties

Compound NameN-methyl-3,6-dihydro-2H-pyran-4-carboxamide
PubChem CID131175874
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC NameN-methyl-3,6-dihydro-2H-pyran-4-carboxamide
SMILESCNC(=O)C1=CCOCC1
InChIInChI=1S/C7H11NO2/c1-8-7(9)6-2-4-10-5-3-6/h2H,3-5H2,1H3,(H,8,9)
InChIKeyPAPHMAFWDWPSAI-UHFFFAOYSA-N
XLogP0.08
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3,6-dihydro-2H-pyran-4-carboxamide?
The IUPAC name of N-methyl-3,6-dihydro-2H-pyran-4-carboxamide (CID 131175874) is N-methyl-3,6-dihydro-2H-pyran-4-carboxamide.
What is the SMILES notation for N-methyl-3,6-dihydro-2H-pyran-4-carboxamide?
The canonical SMILES for N-methyl-3,6-dihydro-2H-pyran-4-carboxamide is CNC(=O)C1=CCOCC1.
What is the InChIKey of N-methyl-3,6-dihydro-2H-pyran-4-carboxamide?
The InChIKey is PAPHMAFWDWPSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2/c1-8-7(9)6-2-4-10-5-3-6/h2H,3-5H2,1H3,(H,8,9).
What are the key properties of N-methyl-3,6-dihydro-2H-pyran-4-carboxamide?
N-methyl-3,6-dihydro-2H-pyran-4-carboxamide has a molecular weight of 141.17 g/mol, XLogP of 0.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3,6-dihydro-2H-pyran-4-carboxamide is sourced from PubChem (CID 131175874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).