2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide

C10H18N2O2 — CID 62065786

IUPAC2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNCC1CCC=CO1
InChIInChI=1S/C10H18N2O2/c1-12(2)10(13)8-11-7-9-5-3-4-6-14-9/h4,6,9,11H,3,5,7-8H2,1-2H3
InChIKeyOVXOIAKOILNLAI-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.36
Rot. Bonds4

About 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide

2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide (PubChem CID 62065786) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide
PubChem CID62065786
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNCC1CCC=CO1
InChIInChI=1S/C10H18N2O2/c1-12(2)10(13)8-11-7-9-5-3-4-6-14-9/h4,6,9,11H,3,5,7-8H2,1-2H3
InChIKeyOVXOIAKOILNLAI-UHFFFAOYSA-N
XLogP0.36
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide?
The IUPAC name of 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide (CID 62065786) is 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide?
The canonical SMILES for 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide is CN(C)C(=O)CNCC1CCC=CO1.
What is the InChIKey of 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide?
The InChIKey is OVXOIAKOILNLAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-12(2)10(13)8-11-7-9-5-3-4-6-14-9/h4,6,9,11H,3,5,7-8H2,1-2H3.
What are the key properties of 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide?
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide has a molecular weight of 198.27 g/mol, XLogP of 0.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylacetamide is sourced from PubChem (CID 62065786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).