2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide

C11H24N2O3 — CID 60686353

IUPAC2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CN(CCO)CCO
InChIInChI=1S/C11H24N2O3/c1-10(2)3-4-12-11(16)9-13(5-7-14)6-8-15/h10,14-15H,3-9H2,1-2H3,(H,12,16)
InChIKeyYSRWCKIDXIZQEA-UHFFFAOYSA-N
MW232.32 g/mol
LogP-0.56
Rot. Bonds9

About 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide

2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide (PubChem CID 60686353) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide.

Molecular Properties

Compound Name2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide
PubChem CID60686353
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CN(CCO)CCO
InChIInChI=1S/C11H24N2O3/c1-10(2)3-4-12-11(16)9-13(5-7-14)6-8-15/h10,14-15H,3-9H2,1-2H3,(H,12,16)
InChIKeyYSRWCKIDXIZQEA-UHFFFAOYSA-N
XLogP-0.56
TPSA72.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[bis(3-methylbutyl)amino]-N-(2-hydroxyethyl)acetamide
CID 107870710
2-[bis(2-hydroxyethyl)amino]-N-propylacetamide
CID 60686308
2-[butyl(2-hydroxyethyl)amino]-N-(2-hydroxyethyl)acetamide
CID 61446926
3-[[2-(butylamino)-2-oxoethyl]-(2-hydroxyethyl)amino]-2-methylpropanoic acid
CID 82327238
2-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethyl-[2-(3-methylbutylamino)-2-oxoethyl]amino]-N-propylacetamide
CID 170012060
2-[2-hydroxyethyl(propyl)amino]-N-(3-propan-2-yloxypropyl)acetamide
CID 60696638
4-[methyl-[2-(3-methylbutylamino)-2-oxoethyl]amino]butanoic acid
CID 55005840
3-[2-hydroxyethyl-[2-(2-methoxyethylamino)-2-oxoethyl]amino]propanoic acid
CID 82327156
N,N'-bis(3-methylbutyl)hexanediamide
CID 5045138
2-[butyl(3-methylbutyl)amino]-N-(3,3-dimethylbutyl)acetamide
CID 121265189
2-[(1-amino-2-methylpropan-2-yl)-methylamino]-N-(3-methylbutyl)acetamide
CID 62007957
4-hydroxy-N-(3-methylbutyl)pentanamide
CID 79001671

Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide?
The IUPAC name of 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide (CID 60686353) is 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide.
What is the SMILES notation for 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide?
The canonical SMILES for 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide is CC(C)CCNC(=O)CN(CCO)CCO.
What is the InChIKey of 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide?
The InChIKey is YSRWCKIDXIZQEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-10(2)3-4-12-11(16)9-13(5-7-14)6-8-15/h10,14-15H,3-9H2,1-2H3,(H,12,16).
What are the key properties of 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide?
2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide has a molecular weight of 232.32 g/mol, XLogP of -0.56, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-hydroxyethyl)amino]-N-(3-methylbutyl)acetamide is sourced from PubChem (CID 60686353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).