N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide

C12H26N4O — CID 62636869

IUPACN-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide
SMILESCC(C)N(C)CCNC(=O)CN1CCNCC1
InChIInChI=1S/C12H26N4O/c1-11(2)15(3)7-6-14-12(17)10-16-8-4-13-5-9-16/h11,13H,4-10H2,1-3H3,(H,14,17)
InChIKeyCUNZOAPXFHKYFS-UHFFFAOYSA-N
MW242.37 g/mol
LogP-0.65
Rot. Bonds6

About N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide

N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide (PubChem CID 62636869) has the molecular formula C12H26N4O and a molecular weight of 242.37 g/mol. Its IUPAC name is N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide.

Molecular Properties

Compound NameN-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide
PubChem CID62636869
Molecular FormulaC12H26N4O
Molecular Weight242.37 g/mol
Exact Mass242.21
IUPAC NameN-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide
SMILESCC(C)N(C)CCNC(=O)CN1CCNCC1
InChIInChI=1S/C12H26N4O/c1-11(2)15(3)7-6-14-12(17)10-16-8-4-13-5-9-16/h11,13H,4-10H2,1-3H3,(H,14,17)
InChIKeyCUNZOAPXFHKYFS-UHFFFAOYSA-N
XLogP-0.65
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylpropanamide
CID 80550020
2-(1,4-diazepan-1-yl)-N-[3-(dimethylamino)propyl]acetamide
CID 54773686
2-(1,4-diazepan-1-yl)-N-[2-(diethylamino)ethyl]acetamide
CID 54773681
N-[2-[[2-(1,4-diazepan-1-yl)acetyl]amino]ethyl]-2-methylpropanamide
CID 62839250
ethane;N-[2-[methyl(propan-2-yl)amino]ethyl]-2-[4-[(1-propanoylpiperidin-4-yl)methyl]piperazin-1-yl]acetamide;propane
CID 176577196
N-(2-methoxypropyl)-2-piperazin-1-ylacetamide;dihydrochloride
CID 69457989
2-(4-aminopiperidin-1-yl)-N-[4-[methyl(propan-2-yl)amino]butyl]acetamide
CID 79328181
trimethyl-[2-[[2-(1,4,7,10-tetrazacyclododec-1-yl)acetyl]amino]ethyl]azanium
CID 11724349
N-[3-(N-methylanilino)propyl]-2-piperazin-1-ylacetamide
CID 29008728
2-hydroxy-4-[(2-piperazin-1-ylacetyl)amino]butanoic acid
CID 107836104
2-(1,4-diazepan-1-yl)-N-(2-methylsulfonylethyl)acetamide
CID 62837051
methyl 3-[[2-(1,4-diazepan-1-yl)acetyl]amino]propanoate
CID 62837481

Frequently Asked Questions

What is the IUPAC name of N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide?
The IUPAC name of N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide (CID 62636869) is N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide.
What is the SMILES notation for N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide?
The canonical SMILES for N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide is CC(C)N(C)CCNC(=O)CN1CCNCC1.
What is the InChIKey of N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide?
The InChIKey is CUNZOAPXFHKYFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4O/c1-11(2)15(3)7-6-14-12(17)10-16-8-4-13-5-9-16/h11,13H,4-10H2,1-3H3,(H,14,17).
What are the key properties of N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide?
N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide has a molecular weight of 242.37 g/mol, XLogP of -0.65, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[methyl(propan-2-yl)amino]ethyl]-2-piperazin-1-ylacetamide is sourced from PubChem (CID 62636869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).