5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide

C15H32N4O — CID 63635938

IUPAC5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CCCN1CCN(C)C(C)C1)C(N)=O
InChIInChI=1S/C15H32N4O/c1-5-8-17-15(3,14(16)20)7-6-9-19-11-10-18(4)13(2)12-19/h13,17H,5-12H2,1-4H3,(H2,16,20)
InChIKeyHNZBKBKGCRBVAW-UHFFFAOYSA-N
MW284.45 g/mol
LogP0.65
Rot. Bonds8

About 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide

5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide (PubChem CID 63635938) has the molecular formula C15H32N4O and a molecular weight of 284.45 g/mol. Its IUPAC name is 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide.

Molecular Properties

Compound Name5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide
PubChem CID63635938
Molecular FormulaC15H32N4O
Molecular Weight284.45 g/mol
Exact Mass284.26
IUPAC Name5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CCCN1CCN(C)C(C)C1)C(N)=O
InChIInChI=1S/C15H32N4O/c1-5-8-17-15(3,14(16)20)7-6-9-19-11-10-18(4)13(2)12-19/h13,17H,5-12H2,1-4H3,(H2,16,20)
InChIKeyHNZBKBKGCRBVAW-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

5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanoic acid
CID 63635242
2-methyl-5-(2-methyl-1,4-oxazepan-4-yl)-2-(propylamino)pentanamide
CID 62974573
5-[3-(methoxymethyl)piperidin-1-yl]-2-methyl-2-(propylamino)pentanamide
CID 106588668
2-(ethylamino)-5-(4-ethyl-3-methylpiperazin-1-yl)-2-methylpentanamide
CID 63634712
6-(3-methoxypiperidin-1-yl)-2-methyl-2-(propylamino)hexanamide
CID 102966457
5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
CID 62330562
2-methyl-2-(propylamino)-3-(3,4,5-trimethylpiperazin-1-yl)propanamide
CID 114539368
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
4-(3,4-dimethylpiperazin-1-yl)-2-(ethylamino)-2-methylbutanoic acid
CID 55218139
N-[3-(3,4-dimethylpiperazin-1-yl)propyl]-2-methylpropan-2-amine
CID 63609125
2-methyl-4-[4-(2-methylpropyl)piperazin-1-yl]-2-(propylamino)butanamide
CID 62778180

Frequently Asked Questions

What is the IUPAC name of 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The IUPAC name of 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide (CID 63635938) is 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide.
What is the SMILES notation for 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The canonical SMILES for 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide is CCCNC(C)(CCCN1CCN(C)C(C)C1)C(N)=O.
What is the InChIKey of 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The InChIKey is HNZBKBKGCRBVAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O/c1-5-8-17-15(3,14(16)20)7-6-9-19-11-10-18(4)13(2)12-19/h13,17H,5-12H2,1-4H3,(H2,16,20).
What are the key properties of 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide?
5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide 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 5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide is sourced from PubChem (CID 63635938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).