N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide

C14H25N3O4 — CID 60689171

IUPACN-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCCCCN(CCO)CC(=O)NC(=O)CN1CCCC1=O
InChIInChI=1S/C14H25N3O4/c1-2-3-6-16(8-9-18)10-12(19)15-13(20)11-17-7-4-5-14(17)21/h18H,2-11H2,1H3,(H,15,19,20)
InChIKeyHBBAPTWCPAIOMK-UHFFFAOYSA-N
MW299.37 g/mol
LogP-0.65
Rot. Bonds9

About N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide

N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 60689171) has the molecular formula C14H25N3O4 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID60689171
Molecular FormulaC14H25N3O4
Molecular Weight299.37 g/mol
Exact Mass299.18
IUPAC NameN-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCCCCN(CCO)CC(=O)NC(=O)CN1CCCC1=O
InChIInChI=1S/C14H25N3O4/c1-2-3-6-16(8-9-18)10-12(19)15-13(20)11-17-7-4-5-14(17)21/h18H,2-11H2,1H3,(H,15,19,20)
InChIKeyHBBAPTWCPAIOMK-UHFFFAOYSA-N
XLogP-0.65
TPSA89.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[ethyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 60686109
N-acetyl-2-(2-oxopyrrolidin-1-yl)acetamide;ethane;molecular hydrogen
CID 144970843
2-[2-oxo-2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]ethyl]sulfanylbutanoic acid
CID 105353266
3-methyl-2-[2-oxo-2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]ethyl]sulfanylbutanoic acid
CID 105354154
N-(4-hydroxybutyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 106843150
N-[2-[methyl(pyrrolidin-3-yl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 63297725
N,N-dibutylbutan-1-amine;1-[3-(dimethylamino)propyl]pyrrolidin-2-one
CID 67848441
N-(4-hydroxy-2-methylbutan-2-yl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 115968684
N-[2-[methyl(piperidin-3-yl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 63643556
N-[2-[butyl(2-hydroxyethyl)amino]acetyl]benzamide
CID 60689022
2-[butyl(2-hydroxyethyl)amino]-N-(2-hydroxyethyl)acetamide
CID 61446926
N-[2-(dimethylamino)ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide;hydrochloride
CID 21327798

Frequently Asked Questions

What is the IUPAC name of N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide (CID 60689171) is N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide is CCCCN(CCO)CC(=O)NC(=O)CN1CCCC1=O.
What is the InChIKey of N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is HBBAPTWCPAIOMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4/c1-2-3-6-16(8-9-18)10-12(19)15-13(20)11-17-7-4-5-14(17)21/h18H,2-11H2,1H3,(H,15,19,20).
What are the key properties of N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 299.37 g/mol, XLogP of -0.65, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[butyl(2-hydroxyethyl)amino]acetyl]-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 60689171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).