N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide

C9H20N4O — CID 59002100

IUPACN-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide
SMILESCCNC(=O)CNN1CCN(C)CC1
InChIInChI=1S/C9H20N4O/c1-3-10-9(14)8-11-13-6-4-12(2)5-7-13/h11H,3-8H2,1-2H3,(H,10,14)
InChIKeyUBPSILNQQHWGLY-UHFFFAOYSA-N
MW200.29 g/mol
LogP-1.13
Rot. Bonds4

About N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide

N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide (PubChem CID 59002100) has the molecular formula C9H20N4O and a molecular weight of 200.29 g/mol. Its IUPAC name is N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide
PubChem CID59002100
Molecular FormulaC9H20N4O
Molecular Weight200.29 g/mol
Exact Mass200.16
IUPAC NameN-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide
SMILESCCNC(=O)CNN1CCN(C)CC1
InChIInChI=1S/C9H20N4O/c1-3-10-9(14)8-11-13-6-4-12(2)5-7-13/h11H,3-8H2,1-2H3,(H,10,14)
InChIKeyUBPSILNQQHWGLY-UHFFFAOYSA-N
XLogP-1.13
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.29
LogP ≤ 5-1.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide?
The IUPAC name of N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide (CID 59002100) is N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide.
What is the SMILES notation for N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide?
The canonical SMILES for N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide is CCNC(=O)CNN1CCN(C)CC1.
What is the InChIKey of N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide?
The InChIKey is UBPSILNQQHWGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4O/c1-3-10-9(14)8-11-13-6-4-12(2)5-7-13/h11H,3-8H2,1-2H3,(H,10,14).
What are the key properties of N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide?
N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide has a molecular weight of 200.29 g/mol, XLogP of -1.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(4-methylpiperazin-1-yl)amino]acetamide is sourced from PubChem (CID 59002100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).