2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide

C11H24N2O2 — CID 104593762

IUPAC2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide
SMILESCCC(CC)C(=O)NCCNCC(C)O
InChIInChI=1S/C11H24N2O2/c1-4-10(5-2)11(15)13-7-6-12-8-9(3)14/h9-10,12,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyPZENELHKLLQVPY-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.51
Rot. Bonds8

About 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide

2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide (PubChem CID 104593762) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide
PubChem CID104593762
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide
SMILESCCC(CC)C(=O)NCCNCC(C)O
InChIInChI=1S/C11H24N2O2/c1-4-10(5-2)11(15)13-7-6-12-8-9(3)14/h9-10,12,14H,4-8H2,1-3H3,(H,13,15)
InChIKeyPZENELHKLLQVPY-UHFFFAOYSA-N
XLogP0.51
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]hexanamide
CID 113430445
2-ethyl-N-[(2R)-2-hydroxypropyl]butanamide
CID 39236453
N-[2-(2-hydroxypropylamino)ethyl]butanamide
CID 104593451
N-[2-(2-hydroxypropylamino)ethyl]prop-2-enamide
CID 104593753
N-[2-(2-hydroxypropylamino)ethyl]but-2-ynamide
CID 107990806
N-[2-(2-hydroxypropylamino)ethyl]-3-methylfuran-2-carboxamide
CID 104593838
N-(2-aminopropyl)-2-ethylbutanamide
CID 63732725
N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide
CID 64541693
3,5-dichloro-N-[2-(2-hydroxypropylamino)ethyl]benzamide
CID 113430430
N-[(2S)-2-hydroxypropyl]-2-propylpentanamide
CID 10058650
N-[2-(2-hydroxypropylamino)ethyl]pyrrolidine-1-carboxamide
CID 104593868
(2R)-1-[2-(methylamino)ethylamino]propan-2-ol
CID 143132001

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide?
The IUPAC name of 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide (CID 104593762) is 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide?
The canonical SMILES for 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide is CCC(CC)C(=O)NCCNCC(C)O.
What is the InChIKey of 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide?
The InChIKey is PZENELHKLLQVPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-10(5-2)11(15)13-7-6-12-8-9(3)14/h9-10,12,14H,4-8H2,1-3H3,(H,13,15).
What are the key properties of 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide?
2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide has a molecular weight of 216.32 g/mol, XLogP of 0.51, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide is sourced from PubChem (CID 104593762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).