2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide

C14H30N2O2 — CID 62016068

IUPAC2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CN(CCO)C(CC)CC
InChIInChI=1S/C14H30N2O2/c1-5-8-12(4)15-14(18)11-16(9-10-17)13(6-2)7-3/h12-13,17H,5-11H2,1-4H3,(H,15,18)
InChIKeyFOZJARSKOJVBCP-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.77
Rot. Bonds10

About 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide

2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide (PubChem CID 62016068) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide
PubChem CID62016068
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CN(CCO)C(CC)CC
InChIInChI=1S/C14H30N2O2/c1-5-8-12(4)15-14(18)11-16(9-10-17)13(6-2)7-3/h12-13,17H,5-11H2,1-4H3,(H,15,18)
InChIKeyFOZJARSKOJVBCP-UHFFFAOYSA-N
XLogP1.77
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-hydroxyethyl(pentan-3-yl)amino]-N-propylacetamide
CID 62016057
2-[butyl(2-hydroxyethyl)amino]-N-pentan-2-ylacetamide
CID 60689454
2-[2-hydroxyethyl(propyl)amino]-N-pentan-2-ylpropanamide
CID 62014640
N-butan-2-yl-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60691813
2-[2-aminoethyl(pentan-3-yl)amino]-N-(1-methoxypropan-2-yl)acetamide
CID 63764416
2-[2-hydroxyethyl(propan-2-yl)amino]-N-(3-methylbutan-2-yl)acetamide
CID 60691834
2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-N-pentan-2-ylpropanamide
CID 107485178
N-cyclopentyl-2-[2-hydroxyethyl(pentan-3-yl)amino]acetamide
CID 62015869
2-[2-hydroxyethyl(pentan-3-yl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 62014316
2-[2-aminopropyl(methyl)amino]-N-pentan-2-ylacetamide
CID 63759359
2-[2-hydroxyethyl(methyl)amino]-N-pentan-2-ylpropanamide
CID 62020256
3-[2-hydroxyethyl(pentan-3-yl)amino]propanehydrazide
CID 63585165

Frequently Asked Questions

What is the IUPAC name of 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide?
The IUPAC name of 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide (CID 62016068) is 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide?
The canonical SMILES for 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide is CCCC(C)NC(=O)CN(CCO)C(CC)CC.
What is the InChIKey of 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide?
The InChIKey is FOZJARSKOJVBCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-5-8-12(4)15-14(18)11-16(9-10-17)13(6-2)7-3/h12-13,17H,5-11H2,1-4H3,(H,15,18).
What are the key properties of 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide?
2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide has a molecular weight of 258.41 g/mol, XLogP of 1.77, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-hydroxyethyl(pentan-3-yl)amino]-N-pentan-2-ylacetamide is sourced from PubChem (CID 62016068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).