2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide

C12H26N2O3 — CID 60720233

IUPAC2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)NCCOCCO
InChIInChI=1S/C12H26N2O3/c1-5-12(3,4)14-11(16)10(2)13-6-8-17-9-7-15/h10,13,15H,5-9H2,1-4H3,(H,14,16)
InChIKeyYMLPAMAOMYDSCQ-UHFFFAOYSA-N
MW246.35 g/mol
LogP0.28
Rot. Bonds9

About 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide

2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide (PubChem CID 60720233) has the molecular formula C12H26N2O3 and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide
PubChem CID60720233
Molecular FormulaC12H26N2O3
Molecular Weight246.35 g/mol
Exact Mass246.19
IUPAC Name2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide
SMILESCCC(C)(C)NC(=O)C(C)NCCOCCO
InChIInChI=1S/C12H26N2O3/c1-5-12(3,4)14-11(16)10(2)13-6-8-17-9-7-15/h10,13,15H,5-9H2,1-4H3,(H,14,16)
InChIKeyYMLPAMAOMYDSCQ-UHFFFAOYSA-N
XLogP0.28
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-butoxyethylamino)-N-(2-methylbutan-2-yl)propanamide
CID 61170101
2-(3-hydroxypropylamino)-N-(2-methylbutan-2-yl)propanamide
CID 43416442
2-[2-(2-hydroxyethoxy)ethylamino]-N-propan-2-ylpropanamide
CID 60654173
N-(2-methylbutan-2-yl)-2-(3-methylbutylamino)propanamide
CID 43112990
2-(ethylamino)-N-(2-methylbutan-2-yl)propanamide
CID 43112409
N-(2-methylbutan-2-yl)-2-(pentylamino)propanamide
CID 43112752
2-[2-(dimethylamino)ethylamino]-N-(2-methylbutan-2-yl)propanamide
CID 43112399
N-(2-methylbutan-2-yl)-2-(3,3,3-trifluoropropylamino)propanamide
CID 55173400
2-[2-(2-hydroxyethoxy)ethylamino]-N-prop-2-ynylpropanamide
CID 60720256
2-[2-(2-hydroxyethoxy)ethylamino]-N,N-dimethylpropanamide
CID 60672617
N-(2-methylbutan-2-yl)-2-(2-methylbutan-2-ylamino)propanamide
CID 43116529
2-(4-hydroxybutan-2-ylamino)-N-(2-methylbutan-2-yl)propanamide
CID 83176935

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide?
The IUPAC name of 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide (CID 60720233) is 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide is CCC(C)(C)NC(=O)C(C)NCCOCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide?
The InChIKey is YMLPAMAOMYDSCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O3/c1-5-12(3,4)14-11(16)10(2)13-6-8-17-9-7-15/h10,13,15H,5-9H2,1-4H3,(H,14,16).
What are the key properties of 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide?
2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide has a molecular weight of 246.35 g/mol, XLogP of 0.28, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethoxy)ethylamino]-N-(2-methylbutan-2-yl)propanamide is sourced from PubChem (CID 60720233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).