N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide

C11H21NO2 — CID 115775810

IUPACN-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide
SMILESC=CCN(CCO)C(=O)C(C)CCC
InChIInChI=1S/C11H21NO2/c1-4-6-10(3)11(14)12(7-5-2)8-9-13/h5,10,13H,2,4,6-9H2,1,3H3
InChIKeyMOKKAIKTJIRMHS-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.43
Rot. Bonds7

About N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide

N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide (PubChem CID 115775810) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide
PubChem CID115775810
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide
SMILESC=CCN(CCO)C(=O)C(C)CCC
InChIInChI=1S/C11H21NO2/c1-4-6-10(3)11(14)12(7-5-2)8-9-13/h5,10,13H,2,4,6-9H2,1,3H3
InChIKeyMOKKAIKTJIRMHS-UHFFFAOYSA-N
XLogP1.43
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[(2S)-1-hydroxy-4-methylpentan-2-yl]-N-prop-2-enylacetamide
CID 135072444
N,N-bis(2-hydroxyethyl)-4-methylpentanamide
CID 58679357
N-(2-hydroxyethyl)-N,4-dimethylpentanamide
CID 60740772
N-acetyl-4-methyl-N-prop-2-enylpentanamide
CID 90843819
2-methyl-N,N-bis(prop-2-enyl)pentanamide
CID 4628436
N,N-bis(2-hydroxyethyl)-2-methylpentanamide
CID 61235254
2-[4-Methylpentanoyl(prop-2-enyl)amino]acetic acid
CID 79263794
2-[2-Methylpentanoyl(prop-2-enyl)amino]acetic acid
CID 79264031
2-cyclobutyl-N-(2-hydroxyethyl)-N-prop-2-enylacetamide
CID 103860934
N-(2-hydroxyethyl)-2,2-dimethyl-N-prop-2-enylcyclopropane-1-carboxamide
CID 103860945
N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylcyclopentane-1-carboxamide
CID 104466982
(3S)-3-(aminomethyl)-N-(2-hydroxyethyl)-5-methyl-N-prop-2-enylhexanamide
CID 104869517

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide?
The IUPAC name of N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide (CID 115775810) is N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide is C=CCN(CCO)C(=O)C(C)CCC.
What is the InChIKey of N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide?
The InChIKey is MOKKAIKTJIRMHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-4-6-10(3)11(14)12(7-5-2)8-9-13/h5,10,13H,2,4,6-9H2,1,3H3.
What are the key properties of N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide?
N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide has a molecular weight of 199.29 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-methyl-N-prop-2-enylpentanamide is sourced from PubChem (CID 115775810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).