3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide

C14H20N2O2 — CID 2865212

IUPAC3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide
SMILESCN(C)c1cccc(C(=O)NCC2CCCO2)c1
InChIInChI=1S/C14H20N2O2/c1-16(2)12-6-3-5-11(9-12)14(17)15-10-13-7-4-8-18-13/h3,5-6,9,13H,4,7-8,10H2,1-2H3,(H,15,17)
InChIKeySUNHVMALZKDCNK-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.66
Rot. Bonds4

About 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide

3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide (PubChem CID 2865212) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide
PubChem CID2865212
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide
SMILESCN(C)c1cccc(C(=O)NCC2CCCO2)c1
InChIInChI=1S/C14H20N2O2/c1-16(2)12-6-3-5-11(9-12)14(17)15-10-13-7-4-8-18-13/h3,5-6,9,13H,4,7-8,10H2,1-2H3,(H,15,17)
InChIKeySUNHVMALZKDCNK-UHFFFAOYSA-N
XLogP1.66
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide?
The IUPAC name of 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide (CID 2865212) is 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide?
The canonical SMILES for 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide is CN(C)c1cccc(C(=O)NCC2CCCO2)c1.
What is the InChIKey of 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide?
The InChIKey is SUNHVMALZKDCNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-16(2)12-6-3-5-11(9-12)14(17)15-10-13-7-4-8-18-13/h3,5-6,9,13H,4,7-8,10H2,1-2H3,(H,15,17).
What are the key properties of 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide?
3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(oxolan-2-ylmethyl)benzamide is sourced from PubChem (CID 2865212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).