2-[methyl(2-piperazin-1-ylethyl)amino]butanamide

C11H24N4O — CID 63266206

IUPAC2-[methyl(2-piperazin-1-ylethyl)amino]butanamide
SMILESCCC(C(N)=O)N(C)CCN1CCNCC1
InChIInChI=1S/C11H24N4O/c1-3-10(11(12)16)14(2)8-9-15-6-4-13-5-7-15/h10,13H,3-9H2,1-2H3,(H2,12,16)
InChIKeyJREIDFOPCAMOKQ-UHFFFAOYSA-N
MW228.34 g/mol
LogP-0.91
Rot. Bonds6

About 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide

2-[methyl(2-piperazin-1-ylethyl)amino]butanamide (PubChem CID 63266206) has the molecular formula C11H24N4O and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide.

Molecular Properties

Compound Name2-[methyl(2-piperazin-1-ylethyl)amino]butanamide
PubChem CID63266206
Molecular FormulaC11H24N4O
Molecular Weight228.34 g/mol
Exact Mass228.20
IUPAC Name2-[methyl(2-piperazin-1-ylethyl)amino]butanamide
SMILESCCC(C(N)=O)N(C)CCN1CCNCC1
InChIInChI=1S/C11H24N4O/c1-3-10(11(12)16)14(2)8-9-15-6-4-13-5-7-15/h10,13H,3-9H2,1-2H3,(H2,12,16)
InChIKeyJREIDFOPCAMOKQ-UHFFFAOYSA-N
XLogP-0.91
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[methyl(2-piperazin-1-ylethyl)amino]butanoic acid
CID 64661581
2-methyl-3-[methyl(2-piperazin-1-ylethyl)amino]propanamide
CID 63265226
2-[methyl(propyl)amino]butanamide
CID 62900463
N-butyl-2-[methyl(2-piperazin-1-ylethyl)amino]propanamide
CID 63266204
N,2-dimethyl-N-(2-piperazin-1-ylethyl)propanamide
CID 63265503
2-[methyl(2-piperidin-2-ylethyl)amino]butanamide
CID 66272994
N-(methylcarbamoyl)-2-[methyl(2-piperazin-1-ylethyl)amino]propanamide
CID 63266126
2-[2-hydroxypropyl(methyl)amino]butanamide
CID 62901231
N-methyl-N-(2-piperazin-1-ylethyl)pyrrolidine-1-carboxamide
CID 79161541
1-(4-fluorophenyl)-N-methyl-N-(2-piperazin-1-ylethyl)propan-1-amine
CID 63267366
N-butan-2-yl-N-methyl-4-piperazin-1-ylbutanamide
CID 112514504
N-methyl-N-(2-piperazin-1-ylethyl)-1-thiophen-2-ylpropan-1-amine
CID 63265653

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide?
The IUPAC name of 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide (CID 63266206) is 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide.
What is the SMILES notation for 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide?
The canonical SMILES for 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide is CCC(C(N)=O)N(C)CCN1CCNCC1.
What is the InChIKey of 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide?
The InChIKey is JREIDFOPCAMOKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O/c1-3-10(11(12)16)14(2)8-9-15-6-4-13-5-7-15/h10,13H,3-9H2,1-2H3,(H2,12,16).
What are the key properties of 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide?
2-[methyl(2-piperazin-1-ylethyl)amino]butanamide has a molecular weight of 228.34 g/mol, XLogP of -0.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(2-piperazin-1-ylethyl)amino]butanamide is sourced from PubChem (CID 63266206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).