N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride

C11H25ClN2O2 — CID 119756762

IUPACN-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
SMILESCNCC(C)C(=O)NCCCCCOC.Cl
InChIInChI=1S/C11H24N2O2.ClH/c1-10(9-12-2)11(14)13-7-5-4-6-8-15-3;/h10,12H,4-9H2,1-3H3,(H,13,14);1H
InChIKeyOQNOIRAISQUFIZ-UHFFFAOYSA-N
MW252.79 g/mol
LogP1.20
Rot. Bonds9

About N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride

N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride (PubChem CID 119756762) has the molecular formula C11H25ClN2O2 and a molecular weight of 252.79 g/mol. Its IUPAC name is N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride.

Molecular Properties

Compound NameN-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
PubChem CID119756762
Molecular FormulaC11H25ClN2O2
Molecular Weight252.79 g/mol
Exact Mass252.16
IUPAC NameN-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
SMILESCNCC(C)C(=O)NCCCCCOC.Cl
InChIInChI=1S/C11H24N2O2.ClH/c1-10(9-12-2)11(14)13-7-5-4-6-8-15-3;/h10,12H,4-9H2,1-3H3,(H,13,14);1H
InChIKeyOQNOIRAISQUFIZ-UHFFFAOYSA-N
XLogP1.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.79
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl 6-[[2-methyl-3-(methylamino)propanoyl]amino]hexanoate
CID 119686226
N-[3-[2-methoxyethyl(methyl)amino]propyl]-2-methyl-3-(methylamino)propanamide
CID 119855422
2-methyl-3-(methylamino)-N-[4-(4-methylphenoxy)butyl]propanamide;hydrochloride
CID 119722678
N-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]-2-methyl-3-(methylamino)propanamide
CID 113407197
N-(5,5-dimethylhexyl)-2-methyl-3-(methylamino)propanamide
CID 119775757
(2S)-N-(5-aminopentyl)-3-methoxy-2-methylpropanamide
CID 170069625
N-[3-(3,5-dimethoxyphenoxy)propyl]-2-methyl-3-(methylamino)propanamide
CID 119820871
2-hydroxy-N-(3-methoxypropyl)propanamide
CID 43558715
N-(5-methoxypentyl)-2-methylprop-2-enamide
CID 137383659
(2S)-2-amino-N-(4-methoxybutyl)-3,3-dimethylbutanamide;hydrochloride
CID 119722377
2-methoxy-3-(5-methoxypentylcarbamoylamino)propanoic acid
CID 114144824
2-methoxy-N-(6-methoxyhexyl)acetamide
CID 177338017

Frequently Asked Questions

What is the IUPAC name of N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The IUPAC name of N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride (CID 119756762) is N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride.
What is the SMILES notation for N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The canonical SMILES for N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride is CNCC(C)C(=O)NCCCCCOC.Cl.
What is the InChIKey of N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
The InChIKey is OQNOIRAISQUFIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2.ClH/c1-10(9-12-2)11(14)13-7-5-4-6-8-15-3;/h10,12H,4-9H2,1-3H3,(H,13,14);1H.
What are the key properties of N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride?
N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride has a molecular weight of 252.79 g/mol, XLogP of 1.20, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxypentyl)-2-methyl-3-(methylamino)propanamide;hydrochloride is sourced from PubChem (CID 119756762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).