2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide

C12H23N3O2 — CID 43420346

IUPAC2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)NCC(=O)NC1CC1
InChIInChI=1S/C12H23N3O2/c1-4-15(5-2)12(17)9(3)13-8-11(16)14-10-6-7-10/h9-10,13H,4-8H2,1-3H3,(H,14,16)
InChIKeyWIBXTEUCOLBOMT-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.11
Rot. Bonds7

About 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide

2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide (PubChem CID 43420346) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide.

Molecular Properties

Compound Name2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide
PubChem CID43420346
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)NCC(=O)NC1CC1
InChIInChI=1S/C12H23N3O2/c1-4-15(5-2)12(17)9(3)13-8-11(16)14-10-6-7-10/h9-10,13H,4-8H2,1-3H3,(H,14,16)
InChIKeyWIBXTEUCOLBOMT-UHFFFAOYSA-N
XLogP0.11
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-N,N-diethylpropanamide
CID 43113043
2-[[2-(cyclopentylamino)-2-oxoethyl]amino]-N-cyclopropylpropanamide
CID 113248238
2-(cyclopropylcarbamothioylamino)-N,N-diethylpropanamide
CID 116509964
2-(butan-2-ylamino)-N-(4-hydroxycyclohexyl)acetamide
CID 60852285
2-[(1-amino-1-hydroxyiminopropan-2-yl)amino]-N-cyclopropylacetamide
CID 77029214
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-pentylpropanamide
CID 43420338
2-(1-cyclopentylethylamino)-N,N-diethylpropanamide
CID 62631567
(2R)-2-[[2-(cyclohexylamino)-2-oxoethyl]amino]propanoic acid
CID 83194051
2-(cyclohexylcarbamoylamino)-N,N-diethylpropanamide
CID 115585935
2-(cycloheptylamino)-N,N-diethylpropanamide
CID 43132181
(2S)-2-[[2-(cyclopropylcarbamoylamino)-2-oxoethyl]amino]propanoic acid
CID 83194919
N-(4-aminocyclohexyl)-2-(propan-2-ylamino)acetamide
CID 62319444

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide?
The IUPAC name of 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide (CID 43420346) is 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide.
What is the SMILES notation for 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide?
The canonical SMILES for 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide is CCN(CC)C(=O)C(C)NCC(=O)NC1CC1.
What is the InChIKey of 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide?
The InChIKey is WIBXTEUCOLBOMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-4-15(5-2)12(17)9(3)13-8-11(16)14-10-6-7-10/h9-10,13H,4-8H2,1-3H3,(H,14,16).
What are the key properties of 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide?
2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide has a molecular weight of 241.33 g/mol, XLogP of 0.11, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N,N-diethylpropanamide is sourced from PubChem (CID 43420346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).