2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

C15H28N4O3 — CID 134038335

IUPAC2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SMILESCCN(CC(=O)NCC(=O)N1CCCC1)CC(=O)NC(C)C
InChIInChI=1S/C15H28N4O3/c1-4-18(11-14(21)17-12(2)3)10-13(20)16-9-15(22)19-7-5-6-8-19/h12H,4-11H2,1-3H3,(H,16,20)(H,17,21)
InChIKeyJMVLPTZVLSJEFV-UHFFFAOYSA-N
MW312.41 g/mol
LogP-0.43
Rot. Bonds8

About 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide

2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide (PubChem CID 134038335) has the molecular formula C15H28N4O3 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
PubChem CID134038335
Molecular FormulaC15H28N4O3
Molecular Weight312.41 g/mol
Exact Mass312.22
IUPAC Name2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
SMILESCCN(CC(=O)NCC(=O)N1CCCC1)CC(=O)NC(C)C
InChIInChI=1S/C15H28N4O3/c1-4-18(11-14(21)17-12(2)3)10-13(20)16-9-15(22)19-7-5-6-8-19/h12H,4-11H2,1-3H3,(H,16,20)(H,17,21)
InChIKeyJMVLPTZVLSJEFV-UHFFFAOYSA-N
XLogP-0.43
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 78787831
2-[acetyl(methyl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 56811944
2-[(2-oxo-2-piperidin-1-ylethyl)amino]-N-propan-2-ylacetamide
CID 43402015
2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 75393854
2-[[2-(1,4-diazepan-1-yl)-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 54986600
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 51223648
N-[2-(azepan-1-yl)-2-oxoethyl]pentanamide
CID 112995931
3-amino-N-(2-oxo-2-piperidin-1-ylethyl)butanamide
CID 115738358
1-[2-[ethyl-[2-(ethylamino)-2-oxoethyl]amino]acetyl]piperidine-4-carboxylic acid
CID 62657828
2-(N-methylanilino)-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide
CID 47145142
1-[5-(diethylamino)pentan-2-yl]-2-methyl-3-(2-oxo-2-piperidin-1-ylethyl)guanidine;hydroiodide
CID 110998186
N-[2-(azocan-1-yl)-2-oxoethyl]-3,3-dimethylbutanamide
CID 86828606

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The IUPAC name of 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide (CID 134038335) is 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The canonical SMILES for 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide is CCN(CC(=O)NCC(=O)N1CCCC1)CC(=O)NC(C)C.
What is the InChIKey of 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
The InChIKey is JMVLPTZVLSJEFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O3/c1-4-18(11-14(21)17-12(2)3)10-13(20)16-9-15(22)19-7-5-6-8-19/h12H,4-11H2,1-3H3,(H,16,20)(H,17,21).
What are the key properties of 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide?
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide has a molecular weight of 312.41 g/mol, XLogP of -0.43, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-oxo-2-pyrrolidin-1-ylethyl)acetamide is sourced from PubChem (CID 134038335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).