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

C11H24N4O2 — CID 175195064

IUPACN-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide
SMILESCN1CCN(CC(=O)NCCOCCN)CC1
InChIInChI=1S/C11H24N4O2/c1-14-4-6-15(7-5-14)10-11(16)13-3-9-17-8-2-12/h2-10,12H2,1H3,(H,13,16)
InChIKeyTYHTYJGPQHSKBV-UHFFFAOYSA-N
MW244.34 g/mol
LogP-1.67
Rot. Bonds7

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

N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide (PubChem CID 175195064) has the molecular formula C11H24N4O2 and a molecular weight of 244.34 g/mol. Its IUPAC name is N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide
PubChem CID175195064
Molecular FormulaC11H24N4O2
Molecular Weight244.34 g/mol
Exact Mass244.19
IUPAC NameN-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide
SMILESCN1CCN(CC(=O)NCCOCCN)CC1
InChIInChI=1S/C11H24N4O2/c1-14-4-6-15(7-5-14)10-11(16)13-3-9-17-8-2-12/h2-10,12H2,1H3,(H,13,16)
InChIKeyTYHTYJGPQHSKBV-UHFFFAOYSA-N
XLogP-1.67
TPSA70.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 5-1.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

bis(N-(2-aminoethyl)-2-(4-methylpiperazin-1-yl)acetamide);methane
CID 157343011
2-[4-(3-aminopropyl)piperazin-1-yl]-N-(2-methoxyethyl)acetamide
CID 54956375
2-[4,7-bis(carboxymethyl)-10-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 177276720
N-(3-aminopropyl)-2-[4,7,10-tris[2-(3-aminopropylamino)-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetamide
CID 101418883
2-[4,7-bis(carboxymethyl)-10-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethylamino]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 170919579
2-[4-[2-[2-[2-[2-[2-[(2-bromoacetyl)amino]ethoxy]ethoxy]ethoxy]ethylamino]-2-oxoethyl]-7,10-bis(carboxymethyl)-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 155906794
2-[(4-methylpiperazin-1-yl)methoxy]ethanamine
CID 174243324
N-[2-[2-[2-[2-(4-methylpiperazin-1-yl)ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 164557571
N-(2-hydroxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)acetamide
CID 43509649
methyl 3-[4-[2-(2-methoxyethylamino)-2-oxoethyl]piperazin-1-yl]propanoate
CID 78913615
N-[2-[2-[2-(4-methylpiperazin-1-yl)ethoxy]ethoxy]ethyl]butanamide;molecular hydrogen
CID 155582806
2-[4,7-bis(carboxymethyl)-10-[2-[2-[2-[2-(3,3-dimethylbutoxy)ethoxy]ethoxy]ethylamino]-2-oxoethyl]-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 162505425

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide?
The IUPAC name of N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide (CID 175195064) is N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide?
The canonical SMILES for N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide is CN1CCN(CC(=O)NCCOCCN)CC1.
What is the InChIKey of N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide?
The InChIKey is TYHTYJGPQHSKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2/c1-14-4-6-15(7-5-14)10-11(16)13-3-9-17-8-2-12/h2-10,12H2,1H3,(H,13,16).
What are the key properties of N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide?
N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide has a molecular weight of 244.34 g/mol, XLogP of -1.67, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-aminoethoxy)ethyl]-2-(4-methylpiperazin-1-yl)acetamide is sourced from PubChem (CID 175195064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).