N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide

C15H24N2O3 — CID 103840168

IUPACN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)NCC(C)(O)CN(C)C
InChIInChI=1S/C15H24N2O3/c1-5-20-13-9-7-6-8-12(13)14(18)16-10-15(2,19)11-17(3)4/h6-9,19H,5,10-11H2,1-4H3,(H,16,18)
InChIKeyREEQBOYIYBZSRZ-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.13
Rot. Bonds7

About N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide (PubChem CID 103840168) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide
PubChem CID103840168
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)NCC(C)(O)CN(C)C
InChIInChI=1S/C15H24N2O3/c1-5-20-13-9-7-6-8-12(13)14(18)16-10-15(2,19)11-17(3)4/h6-9,19H,5,10-11H2,1-4H3,(H,16,18)
InChIKeyREEQBOYIYBZSRZ-UHFFFAOYSA-N
XLogP1.13
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;2-ethoxy-N-(2-hydroxy-2-methylpropyl)benzamide
CID 142472938
2-ethoxy-N-(2-hydroxy-4-methoxy-2-methylbutyl)benzamide
CID 103712220
2-ethoxy-N-(2-hydroxy-2-phenylpropyl)benzamide
CID 121111925
2-chloro-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]benzamide
CID 103840160
N-(3-amino-2,2-dimethylpropyl)-2-ethoxybenzamide
CID 115365704
2-ethoxy-N-(2-hydroxy-2,3-dimethylpentyl)benzamide
CID 111446636
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2,6-dimethoxybenzamide
CID 103841084
N-(2-amino-2-ethylbutyl)-2-ethoxybenzamide
CID 81484030
2-ethoxy-N-(3-hydroxy-2,2,4-trimethylpentyl)benzamide
CID 109380671
ethyl 2-[(2-ethoxybenzoyl)amino]acetate
CID 4056517
N-(2,2-difluoro-3-hydroxypropyl)-2-ethoxybenzamide
CID 113462770
2-ethoxy-N-[2-(N-methylanilino)ethyl]benzamide
CID 25395275

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide?
The IUPAC name of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide (CID 103840168) is N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide.
What is the SMILES notation for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide?
The canonical SMILES for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide is CCOc1ccccc1C(=O)NCC(C)(O)CN(C)C.
What is the InChIKey of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide?
The InChIKey is REEQBOYIYBZSRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-5-20-13-9-7-6-8-12(13)14(18)16-10-15(2,19)11-17(3)4/h6-9,19H,5,10-11H2,1-4H3,(H,16,18).
What are the key properties of N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide?
N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide has a molecular weight of 280.37 g/mol, XLogP of 1.13, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-ethoxybenzamide is sourced from PubChem (CID 103840168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).