2-(2-aminoethoxy)-N-hexan-3-ylacetamide

C10H22N2O2 — CID 79478574

IUPAC2-(2-aminoethoxy)-N-hexan-3-ylacetamide
SMILESCCCC(CC)NC(=O)COCCN
InChIInChI=1S/C10H22N2O2/c1-3-5-9(4-2)12-10(13)8-14-7-6-11/h9H,3-8,11H2,1-2H3,(H,12,13)
InChIKeyPRHOCLJZGUAUPM-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.66
Rot. Bonds8

About 2-(2-aminoethoxy)-N-hexan-3-ylacetamide

2-(2-aminoethoxy)-N-hexan-3-ylacetamide (PubChem CID 79478574) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-hexan-3-ylacetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-hexan-3-ylacetamide
PubChem CID79478574
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-(2-aminoethoxy)-N-hexan-3-ylacetamide
SMILESCCCC(CC)NC(=O)COCCN
InChIInChI=1S/C10H22N2O2/c1-3-5-9(4-2)12-10(13)8-14-7-6-11/h9H,3-8,11H2,1-2H3,(H,12,13)
InChIKeyPRHOCLJZGUAUPM-UHFFFAOYSA-N
XLogP0.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.66
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

2-(2-aminoethoxy)-N-(1-methoxybutan-2-yl)acetamide
CID 79478592
N-(1-methoxypentan-2-yl)-2-propoxyacetamide
CID 107941725
7-amino-N-hexan-3-ylheptanamide;hydrochloride
CID 119757664
2-amino-N-[2-(hexan-3-ylamino)-2-oxoethyl]acetamide
CID 62117084
N-[(2R)-1-hydroxybutan-2-yl]-2-(2-methoxyethoxy)acetamide
CID 103920046
2-(2-aminoethoxy)-N-(4-methylsulfanylbutan-2-yl)acetamide
CID 115740075
N-(1-aminohexan-2-yl)-2-(2-methoxyethoxy)acetamide;hydrochloride
CID 119667872
2-[[2-(2-aminoethoxy)acetyl]amino]-5-methoxy-5-oxopentanoic acid
CID 82786420
2-(2-aminoethoxy)-N-ethylacetamide
CID 62343422
2-(2-aminoethoxy)-N-(1-hydroxy-3-methylbutan-2-yl)acetamide
CID 79479783
2-[[2-(2-aminoethoxy)acetyl]amino]-N-methylpropanamide
CID 79478783
2-(2-aminoethoxy)-N-(1-ethylsulfanylpropan-2-yl)acetamide
CID 115739921

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-hexan-3-ylacetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-hexan-3-ylacetamide (CID 79478574) is 2-(2-aminoethoxy)-N-hexan-3-ylacetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-hexan-3-ylacetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-hexan-3-ylacetamide is CCCC(CC)NC(=O)COCCN.
What is the InChIKey of 2-(2-aminoethoxy)-N-hexan-3-ylacetamide?
The InChIKey is PRHOCLJZGUAUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-3-5-9(4-2)12-10(13)8-14-7-6-11/h9H,3-8,11H2,1-2H3,(H,12,13).
What are the key properties of 2-(2-aminoethoxy)-N-hexan-3-ylacetamide?
2-(2-aminoethoxy)-N-hexan-3-ylacetamide has a molecular weight of 202.30 g/mol, XLogP of 0.66, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-hexan-3-ylacetamide is sourced from PubChem (CID 79478574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).