N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide

C13H27N3O — CID 43274010

IUPACN-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide
SMILESCCN(CC(C)C)C(=O)C(C)N1CCNCC1
InChIInChI=1S/C13H27N3O/c1-5-15(10-11(2)3)13(17)12(4)16-8-6-14-7-9-16/h11-12,14H,5-10H2,1-4H3
InChIKeyODSDQDFVDFNNEV-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.78
Rot. Bonds5

About N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide

N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide (PubChem CID 43274010) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide
PubChem CID43274010
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide
SMILESCCN(CC(C)C)C(=O)C(C)N1CCNCC1
InChIInChI=1S/C13H27N3O/c1-5-15(10-11(2)3)13(17)12(4)16-8-6-14-7-9-16/h11-12,14H,5-10H2,1-4H3
InChIKeyODSDQDFVDFNNEV-UHFFFAOYSA-N
XLogP0.78
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxyethyl)-N-ethyl-2-piperazin-1-ylpropanamide
CID 63691474
N-cyclopropyl-N-ethyl-2-piperazin-1-ylpropanamide
CID 43264445
N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide
CID 55000406
(2R)-N,N-dimethyl-2-piperazin-1-ylpropanamide
CID 28906098
N-ethyl-N-(oxolan-2-ylmethyl)-2-piperazin-1-ylpropanamide
CID 61435034
N-[2-(methylamino)-2-oxoethyl]-2-piperazin-1-yl-N-propylpropanamide
CID 54985265
N-butyl-N-methyl-2-piperazin-1-ylpropanamide
CID 43130649
N-(2-hydroxyethyl)-2-piperazin-1-yl-N-propan-2-ylpropanamide
CID 54995362
N-(1-cyanopropan-2-yl)-N-methyl-2-piperazin-1-ylpropanamide
CID 55174159
N-butyl-N-cyclopropyl-2-piperazin-1-ylpropanamide
CID 61442974
N-ethyl-N-(2-methylpropyl)-3-piperidin-4-ylbutanamide
CID 119732319
methyl 2-[methyl(2-piperazin-1-ylpropanoyl)amino]acetate
CID 43130551

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide?
The IUPAC name of N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide (CID 43274010) is N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide is CCN(CC(C)C)C(=O)C(C)N1CCNCC1.
What is the InChIKey of N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide?
The InChIKey is ODSDQDFVDFNNEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-5-15(10-11(2)3)13(17)12(4)16-8-6-14-7-9-16/h11-12,14H,5-10H2,1-4H3.
What are the key properties of N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide?
N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide has a molecular weight of 241.38 g/mol, XLogP of 0.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 43274010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).