2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

C13H23N3O3 — CID 60510656

IUPAC2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SMILESO=C(CN(CCO)C1CC1)NCC(=O)N1CCCC1
InChIInChI=1S/C13H23N3O3/c17-8-7-16(11-3-4-11)10-12(18)14-9-13(19)15-5-1-2-6-15/h11,17H,1-10H2,(H,14,18)
InChIKeyXATNKCWATYCVCF-UHFFFAOYSA-N
MW269.34 g/mol
LogP-0.82
Rot. Bonds7

About 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide (PubChem CID 60510656) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
PubChem CID60510656
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC Name2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SMILESO=C(CN(CCO)C1CC1)NCC(=O)N1CCCC1
InChIInChI=1S/C13H23N3O3/c17-8-7-16(11-3-4-11)10-12(18)14-9-13(19)15-5-1-2-6-15/h11,17H,1-10H2,(H,14,18)
InChIKeyXATNKCWATYCVCF-UHFFFAOYSA-N
XLogP-0.82
TPSA72.88 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 5-0.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The IUPAC name of 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide (CID 60510656) is 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The canonical SMILES for 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide is O=C(CN(CCO)C1CC1)NCC(=O)N1CCCC1.
What is the InChIKey of 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The InChIKey is XATNKCWATYCVCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c17-8-7-16(11-3-4-11)10-12(18)14-9-13(19)15-5-1-2-6-15/h11,17H,1-10H2,(H,14,18).
What are the key properties of 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide has a molecular weight of 269.34 g/mol, XLogP of -0.82, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(2-hydroxyethyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide is sourced from PubChem (CID 60510656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).