3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide

C15H22N2O2 — CID 94022695

IUPAC3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide
SMILESCN(C)c1cccc(C(=O)NCC[C@H]2CCCO2)c1
InChIInChI=1S/C15H22N2O2/c1-17(2)13-6-3-5-12(11-13)15(18)16-9-8-14-7-4-10-19-14/h3,5-6,11,14H,4,7-10H2,1-2H3,(H,16,18)/t14-/m1/s1
InChIKeySHNWQRWBDNERAM-CQSZACIVSA-N
MW262.35 g/mol
LogP2.05
Rot. Bonds5

About 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide

3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide (PubChem CID 94022695) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide
PubChem CID94022695
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide
SMILESCN(C)c1cccc(C(=O)NCC[C@H]2CCCO2)c1
InChIInChI=1S/C15H22N2O2/c1-17(2)13-6-3-5-12(11-13)15(18)16-9-8-14-7-4-10-19-14/h3,5-6,11,14H,4,7-10H2,1-2H3,(H,16,18)/t14-/m1/s1
InChIKeySHNWQRWBDNERAM-CQSZACIVSA-N
XLogP2.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-[2-(oxolan-2-yl)ethylcarbamoyl]benzoate
CID 51086480
3-amino-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 54915842
3-acetamido-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 110745062
3-iodo-N-[2-(oxan-2-yl)ethyl]benzamide
CID 103993198
3-amino-4-methyl-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 54915859
3-methyl-4-(methylamino)-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 55164039
3-[3-(dimethylamino)phenyl]-N-[2-[(3S)-oxolan-3-yl]ethyl]benzamide
CID 125174087
3-(dimethylamino)-N-[N-(2,5-dimethylphenyl)-N'-[[(2R)-oxolan-2-yl]methyl]carbamimidoyl]benzamide
CID 94089702
3-(dimethylamino)-N-(oxolan-3-ylmethyl)benzamide
CID 47179453
3-(dimethylamino)-N-[1-[[(2S)-oxan-2-yl]methyl]pyrazol-4-yl]benzamide
CID 129356187
6-oxo-N-[2-(oxolan-2-yl)ethyl]-1H-pyridine-3-carboxamide
CID 60734395
3-(dimethylamino)-N-[N-(4-fluorophenyl)-N'-(oxolan-2-ylmethyl)carbamimidoyl]benzamide
CID 50820331

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide?
The IUPAC name of 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide (CID 94022695) is 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide?
The canonical SMILES for 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide is CN(C)c1cccc(C(=O)NCC[C@H]2CCCO2)c1.
What is the InChIKey of 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide?
The InChIKey is SHNWQRWBDNERAM-CQSZACIVSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-17(2)13-6-3-5-12(11-13)15(18)16-9-8-14-7-4-10-19-14/h3,5-6,11,14H,4,7-10H2,1-2H3,(H,16,18)/t14-/m1/s1.
What are the key properties of 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide?
3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide has a molecular weight of 262.35 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[2-[(2R)-oxolan-2-yl]ethyl]benzamide is sourced from PubChem (CID 94022695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).