2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide

C15H32N4O — CID 63634712

IUPAC2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide
SMILESCCNC(C)(CCCN1CCN(CC)C(C)C1)C(N)=O
InChIInChI=1S/C15H32N4O/c1-5-17-15(4,14(16)20)8-7-9-18-10-11-19(6-2)13(3)12-18/h13,17H,5-12H2,1-4H3,(H2,16,20)
InChIKeyLWYWLLUPLODGJY-UHFFFAOYSA-N
MW284.45 g/mol
LogP0.65
Rot. Bonds8

About 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide

2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide (PubChem CID 63634712) has the molecular formula C15H32N4O and a molecular weight of 284.45 g/mol. Its IUPAC name is 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide.

Molecular Properties

Compound Name2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide
PubChem CID63634712
Molecular FormulaC15H32N4O
Molecular Weight284.45 g/mol
Exact Mass284.26
IUPAC Name2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide
SMILESCCNC(C)(CCCN1CCN(CC)C(C)C1)C(N)=O
InChIInChI=1S/C15H32N4O/c1-5-17-15(4,14(16)20)8-7-9-18-10-11-19(6-2)13(3)12-18/h13,17H,5-12H2,1-4H3,(H2,16,20)
InChIKeyLWYWLLUPLODGJY-UHFFFAOYSA-N
XLogP0.65
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclopropylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide
CID 63634892
5-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(ethylamino)-2-methylpentanamide
CID 79917010
5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide
CID 63635938
4-(4-ethyl-3-methylpiperazin-1-yl)-2-methyl-2-(methylamino)butanoic acid
CID 63633318
4-(4-ethyl-3-methylpiperazin-1-yl)butanimidamide
CID 63608845
2-(ethylamino)-2-methyl-5-(3,4,5-trimethylpiperazin-1-yl)pentanoic acid
CID 114539447
4-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(ethylamino)-2-methylbutanamide
CID 79935074
4-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-2-(ethylamino)-2-methylbutanamide
CID 63151089
5-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-(ethylamino)-2-methylpentanoic acid
CID 79945721
4-(4-ethyl-3-methylpiperazin-1-yl)-N'-hydroxybutanimidamide
CID 77000710
4-(3,4-dimethylpiperazin-1-yl)-2-(ethylamino)-2-methylbutanoic acid
CID 55218139
6-(4,4-dimethylazepan-1-yl)-2-(ethylamino)-2-methylhexanamide
CID 65281853

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide?
The IUPAC name of 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide (CID 63634712) is 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide.
What is the SMILES notation for 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide?
The canonical SMILES for 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide is CCNC(C)(CCCN1CCN(CC)C(C)C1)C(N)=O.
What is the InChIKey of 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide?
The InChIKey is LWYWLLUPLODGJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O/c1-5-17-15(4,14(16)20)8-7-9-18-10-11-19(6-2)13(3)12-18/h13,17H,5-12H2,1-4H3,(H2,16,20).
What are the key properties of 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide?
2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide has a molecular weight of 284.45 g/mol, XLogP of 0.65, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide is sourced from PubChem (CID 63634712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).