2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide

C13H28N2O2 — CID 60689454

IUPAC2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide
SMILESCCCCN(CCO)CC(=O)NC(C)CCC
InChIInChI=1S/C13H28N2O2/c1-4-6-8-15(9-10-16)11-13(17)14-12(3)7-5-2/h12,16H,4-11H2,1-3H3,(H,14,17)
InChIKeyIDICVDUQYMYART-UHFFFAOYSA-N
MW244.38 g/mol
LogP1.39
Rot. Bonds10

About 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide

2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide (PubChem CID 60689454) has the molecular formula C13H28N2O2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide
PubChem CID60689454
Molecular FormulaC13H28N2O2
Molecular Weight244.38 g/mol
Exact Mass244.22
IUPAC Name2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide
SMILESCCCCN(CCO)CC(=O)NC(C)CCC
InChIInChI=1S/C13H28N2O2/c1-4-6-8-15(9-10-16)11-13(17)14-12(3)7-5-2/h12,16H,4-11H2,1-3H3,(H,14,17)
InChIKeyIDICVDUQYMYART-UHFFFAOYSA-N
XLogP1.39
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60691813
2-[2-hydroxyethyl(propyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 60691833
3-[[2-(butan-2-ylamino)-2-oxoethyl]-butylamino]propanoic acid
CID 82327333
2-[3-aminopropyl(ethyl)amino]-N-pentan-2-ylacetamide
CID 61490080
2-[ethyl(2-hydroxyethyl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 60685750
2-[butyl(2-hydroxyethyl)amino]-N-(2-hydroxyethyl)acetamide
CID 61446926
2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide
CID 62016068
2-[butyl(2-hydroxyethyl)amino]-N,N-di(propan-2-yl)acetamide
CID 60689538
3-[[2-(butan-2-ylamino)-2-oxoethyl]-hexylamino]propanoic acid
CID 82327338
3-[2-[bis(2-hydroxyethyl)amino]ethyl-[3-oxo-3-(tetradecan-2-ylamino)propyl]amino]propanamide
CID 89162934
2-[butyl-[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetamide
CID 51081968
2-[ethyl(3-hydroxypropyl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 115666206

Frequently Asked Questions

What is the IUPAC name of 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide?
The IUPAC name of 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide (CID 60689454) is 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide?
The canonical SMILES for 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide is CCCCN(CCO)CC(=O)NC(C)CCC.
What is the InChIKey of 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide?
The InChIKey is IDICVDUQYMYART-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O2/c1-4-6-8-15(9-10-16)11-13(17)14-12(3)7-5-2/h12,16H,4-11H2,1-3H3,(H,14,17).
What are the key properties of 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide?
2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide has a molecular weight of 244.38 g/mol, XLogP of 1.39, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide is sourced from PubChem (CID 60689454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).