N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide

C11H21NO3 — CID 84578578

IUPACN-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide
SMILESCN(CCO)C(=O)CCC1CCOCC1
InChIInChI=1S/C11H21NO3/c1-12(6-7-13)11(14)3-2-10-4-8-15-9-5-10/h10,13H,2-9H2,1H3
InChIKeyCEXWJIJGUGIRLJ-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.64
Rot. Bonds5

About N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide

N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide (PubChem CID 84578578) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide
PubChem CID84578578
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC NameN-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide
SMILESCN(CCO)C(=O)CCC1CCOCC1
InChIInChI=1S/C11H21NO3/c1-12(6-7-13)11(14)3-2-10-4-8-15-9-5-10/h10,13H,2-9H2,1H3
InChIKeyCEXWJIJGUGIRLJ-UHFFFAOYSA-N
XLogP0.64
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-methyl-N-[2-(oxan-4-yl)ethyl]butanamide
CID 115155515
4-amino-N-methyl-N-[2-(oxan-4-yl)ethyl]pentanamide
CID 115156830
N-(2-hydroxyethyl)-N-methyl-3-(oxolan-2-yl)propanamide
CID 60749979
3-[methyl-[2-(oxan-4-yl)ethyl]amino]-3-oxopropanoic acid
CID 115163624
N-methyl-N-(oxan-4-ylmethyl)-3-piperidin-3-ylpropanamide
CID 63706973
3-(4-aminocyclohexyl)-N-[2-(dimethylamino)ethyl]-N-methylpropanamide
CID 55227765
2-amino-4-[methyl-[2-(oxan-4-yl)ethyl]amino]-4-oxobutanoic acid
CID 115181196
N-(2-cyclohexylethyl)-4-hydroxy-N-methylbutanamide
CID 115163166
N-[2-(dimethylamino)ethyl]-N-methyl-3-piperidin-4-ylpropanamide
CID 55227726
4-amino-3-methoxy-N-methyl-N-[2-(oxan-4-yl)ethyl]butanamide
CID 120593000
1-(oxan-4-yl)hexan-3-one
CID 62385519
methyl 3-(oxan-4-yl)propanoate
CID 55296577

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide (CID 84578578) is N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide is CN(CCO)C(=O)CCC1CCOCC1.
What is the InChIKey of N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide?
The InChIKey is CEXWJIJGUGIRLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-12(6-7-13)11(14)3-2-10-4-8-15-9-5-10/h10,13H,2-9H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide?
N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide has a molecular weight of 215.29 g/mol, XLogP of 0.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methyl-3-(oxan-4-yl)propanamide is sourced from PubChem (CID 84578578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).