N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide

C12H26N2O2 — CID 79209171

IUPACN-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide
SMILESCCCN(CCN(C)C)C(=O)CCCCO
InChIInChI=1S/C12H26N2O2/c1-4-8-14(10-9-13(2)3)12(16)7-5-6-11-15/h15H,4-11H2,1-3H3
InChIKeyRYXHMYIWHZAMQK-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.95
Rot. Bonds9

About N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide

N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide (PubChem CID 79209171) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide
PubChem CID79209171
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide
SMILESCCCN(CCN(C)C)C(=O)CCCCO
InChIInChI=1S/C12H26N2O2/c1-4-8-14(10-9-13(2)3)12(16)7-5-6-11-15/h15H,4-11H2,1-3H3
InChIKeyRYXHMYIWHZAMQK-UHFFFAOYSA-N
XLogP0.95
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-N-[2-(dimethylamino)ethyl]-N-propylpentanamide
CID 107909937
N-[2-[hexadecanoyl(3-hydroxypropyl)amino]ethyl]-N-(3-hydroxypropyl)hexadecanamide
CID 18787706
N,N-dipropylnonadecanamide
CID 12960009
N,N-bis(3-hydroxypropyl)icosanamide
CID 102118836
N,N-bis[3-(dimethylamino)propyl]decanamide
CID 86204992
N-[2-(dimethylamino)ethyl]-4-hydroxy-N-(2-methylpropyl)butanamide
CID 79203472
N-hexyl-8-[5-hydroxypentyl(octyl)amino]-N-octyloctanamide
CID 169189818
N,N-didecyl-6-[[6-(didecylamino)-6-oxohexyl]-(5-hydroxypentyl)amino]hexanamide
CID 168943837
N-ethyl-N-(3-hydroxypropyl)decanamide
CID 115771581
N-ethyl-N-(3-hydroxypropyl)heptanamide
CID 115771582
N-(2-hydroxyethyl)-4-methoxy-N-propylbutanamide
CID 112729251
4-amino-N,N-dipropylbutanamide
CID 12835718

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide (CID 79209171) is N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide is CCCN(CCN(C)C)C(=O)CCCCO.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide?
The InChIKey is RYXHMYIWHZAMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-4-8-14(10-9-13(2)3)12(16)7-5-6-11-15/h15H,4-11H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide?
N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide has a molecular weight of 230.35 g/mol, XLogP of 0.95, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-5-hydroxy-N-propylpentanamide is sourced from PubChem (CID 79209171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).