N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide

C13H26N4O2 — CID 80548281

IUPACN-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide
SMILESCN(C)C(=O)CN(C)C(=O)C(C)(C)N1CCNCC1
InChIInChI=1S/C13H26N4O2/c1-13(2,17-8-6-14-7-9-17)12(19)16(5)10-11(18)15(3)4/h14H,6-10H2,1-5H3
InChIKeyBHBMYRBIHKLDEF-UHFFFAOYSA-N
MW270.38 g/mol
LogP-0.78
Rot. Bonds4

About N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide

N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide (PubChem CID 80548281) has the molecular formula C13H26N4O2 and a molecular weight of 270.38 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide
PubChem CID80548281
Molecular FormulaC13H26N4O2
Molecular Weight270.38 g/mol
Exact Mass270.21
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide
SMILESCN(C)C(=O)CN(C)C(=O)C(C)(C)N1CCNCC1
InChIInChI=1S/C13H26N4O2/c1-13(2,17-8-6-14-7-9-17)12(19)16(5)10-11(18)15(3)4/h14H,6-10H2,1-5H3
InChIKeyBHBMYRBIHKLDEF-UHFFFAOYSA-N
XLogP-0.78
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 5-0.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(ethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide
CID 80548617
N-(2-hydroxy-2-methylpropyl)-N,2-dimethyl-2-piperazin-1-ylpropanamide
CID 80551052
N-(furan-3-ylmethyl)-N,2-dimethyl-2-piperazin-1-ylpropanamide
CID 80548872
N,2-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]-2-piperazin-1-ylpropanamide
CID 80548187
N,N-bis(2-hydroxyethyl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80548772
2-amino-N,2-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
CID 82511586
N,2-dimethyl-2-piperazin-1-yl-N-(thiophen-3-ylmethyl)propanamide
CID 80548409
N-[(5-bromofuran-2-yl)methyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide
CID 80548846
N,2-dimethyl-N-[(3-methylphenyl)methyl]-2-piperazin-1-ylpropanamide
CID 80547402
N-butyl-N-ethyl-2-methyl-2-piperazin-1-ylpropanamide
CID 80548520
N-cyclopropyl-N-(cyclopropylmethyl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80549935
N,N-dimethyl-2-[methyl(piperazin-1-ylsulfonyl)amino]acetamide
CID 43375100

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide (CID 80548281) is N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide is CN(C)C(=O)CN(C)C(=O)C(C)(C)N1CCNCC1.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide?
The InChIKey is BHBMYRBIHKLDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O2/c1-13(2,17-8-6-14-7-9-17)12(19)16(5)10-11(18)15(3)4/h14H,6-10H2,1-5H3.
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide?
N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide has a molecular weight of 270.38 g/mol, XLogP of -0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-N,2-dimethyl-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 80548281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).