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

C10H22N4O2 — CID 70047945

IUPACN-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide
SMILESCC(=O)NC(CN)N1CCN(CCO)CC1
InChIInChI=1S/C10H22N4O2/c1-9(16)12-10(8-11)14-4-2-13(3-5-14)6-7-15/h10,15H,2-8,11H2,1H3,(H,12,16)
InChIKeyQJSXOSKZHNZDON-UHFFFAOYSA-N
MW230.31 g/mol
LogP-1.98
Rot. Bonds5

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

N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide (PubChem CID 70047945) has the molecular formula C10H22N4O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide
PubChem CID70047945
Molecular FormulaC10H22N4O2
Molecular Weight230.31 g/mol
Exact Mass230.17
IUPAC NameN-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide
SMILESCC(=O)NC(CN)N1CCN(CCO)CC1
InChIInChI=1S/C10H22N4O2/c1-9(16)12-10(8-11)14-4-2-13(3-5-14)6-7-15/h10,15H,2-8,11H2,1H3,(H,12,16)
InChIKeyQJSXOSKZHNZDON-UHFFFAOYSA-N
XLogP-1.98
TPSA81.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-1.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide (CID 70047945) is N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide is CC(=O)NC(CN)N1CCN(CCO)CC1.
What is the InChIKey of N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide?
The InChIKey is QJSXOSKZHNZDON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O2/c1-9(16)12-10(8-11)14-4-2-13(3-5-14)6-7-15/h10,15H,2-8,11H2,1H3,(H,12,16).
What are the key properties of N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide?
N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide has a molecular weight of 230.31 g/mol, XLogP of -1.98, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide is sourced from PubChem (CID 70047945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).