N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide

C13H26N2O4 — CID 20740586

IUPACN-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide
SMILESCCC(=O)N(CCO)CCCN(CCO)C(=O)CC
InChIInChI=1S/C13H26N2O4/c1-3-12(18)14(8-10-16)6-5-7-15(9-11-17)13(19)4-2/h16-17H,3-11H2,1-2H3
InChIKeyBXZSVVNWQIMNQN-UHFFFAOYSA-N
MW274.36 g/mol
LogP-0.16
Rot. Bonds10

About N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide

N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide (PubChem CID 20740586) has the molecular formula C13H26N2O4 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide
PubChem CID20740586
Molecular FormulaC13H26N2O4
Molecular Weight274.36 g/mol
Exact Mass274.19
IUPAC NameN-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide
SMILESCCC(=O)N(CCO)CCCN(CCO)C(=O)CC
InChIInChI=1S/C13H26N2O4/c1-3-12(18)14(8-10-16)6-5-7-15(9-11-17)13(19)4-2/h16-17H,3-11H2,1-2H3
InChIKeyBXZSVVNWQIMNQN-UHFFFAOYSA-N
XLogP-0.16
TPSA81.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-hydroxypropyl(propanoyl)amino]propanoic acid
CID 82323236
N-[3-(dimethylamino)propyl]-N-propylpropanamide
CID 142178242
N-butyl-N-(2-hydroxyethyl)-2-methoxyacetamide
CID 20697100
N,N-bis(2-hydroxyethyl)butanamide
CID 14455174
N-[3-(dibutylamino)propyl]-N-octadecylpropanamide
CID 146463655
N-butyl-N-(2-chloroethyl)propanamide
CID 63390792
N,N-bis[2-(2-hydroxyethoxy)ethyl]propanamide
CID 91261493
3-[hexyl(2-hydroxyethyl)amino]-3-oxopropanoic acid
CID 62230259
N-(3-aminopropyl)-N-butylpropanamide;ethane
CID 142121594
N,N-bis(2-hydroxyethyl)-2-methoxyacetamide;ethane
CID 145142021
3-amino-N-butyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 64684879
3-amino-N-hexyl-N-(2-hydroxyethyl)propanamide
CID 60962564

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide?
The IUPAC name of N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide (CID 20740586) is N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide is CCC(=O)N(CCO)CCCN(CCO)C(=O)CC.
What is the InChIKey of N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide?
The InChIKey is BXZSVVNWQIMNQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O4/c1-3-12(18)14(8-10-16)6-5-7-15(9-11-17)13(19)4-2/h16-17H,3-11H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide?
N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide has a molecular weight of 274.36 g/mol, XLogP of -0.16, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-[3-[2-hydroxyethyl(propanoyl)amino]propyl]propanamide is sourced from PubChem (CID 20740586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).