5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide

C15H32N4O — CID 82012149

IUPAC5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide
SMILESCC(CN)CCC(=O)NCC(C)(C)N1CCN(C)CC1
InChIInChI=1S/C15H32N4O/c1-13(11-16)5-6-14(20)17-12-15(2,3)19-9-7-18(4)8-10-19/h13H,5-12,16H2,1-4H3,(H,17,20)
InChIKeyZSOVBKAWDWRQGS-UHFFFAOYSA-N
MW284.45 g/mol
LogP0.50
Rot. Bonds7

About 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide

5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide (PubChem CID 82012149) has the molecular formula C15H32N4O and a molecular weight of 284.45 g/mol. Its IUPAC name is 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide.

Molecular Properties

Compound Name5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide
PubChem CID82012149
Molecular FormulaC15H32N4O
Molecular Weight284.45 g/mol
Exact Mass284.26
IUPAC Name5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide
SMILESCC(CN)CCC(=O)NCC(C)(C)N1CCN(C)CC1
InChIInChI=1S/C15H32N4O/c1-13(11-16)5-6-14(20)17-12-15(2,3)19-9-7-18(4)8-10-19/h13H,5-12,16H2,1-4H3,(H,17,20)
InChIKeyZSOVBKAWDWRQGS-UHFFFAOYSA-N
XLogP0.50
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(aminomethyl)-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide
CID 81086850
3-amino-3-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]butanamide
CID 64677799
2-amino-3-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]butanamide
CID 61274483
2-(1-aminocyclopentyl)-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]acetamide
CID 64677798
(2R)-2-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide
CID 104903261
5-amino-N-[(1,4-dimethylpiperazin-2-yl)methyl]-4-methylpentanamide
CID 82688861
2-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]propane-1,2-diamine
CID 103387653
2-[[2-methyl-2-(4-methylpiperazin-1-yl)propyl]amino]propanoic acid
CID 66173896
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide
CID 106148529
1-(aminomethyl)-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]cyclopentane-1-carboxamide
CID 115435181
7-amino-N-(2-methyl-2-morpholin-4-ylpropyl)heptanamide
CID 61248464
5-amino-4-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pentanamide
CID 82012433

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide?
The IUPAC name of 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide (CID 82012149) is 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide.
What is the SMILES notation for 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide?
The canonical SMILES for 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide is CC(CN)CCC(=O)NCC(C)(C)N1CCN(C)CC1.
What is the InChIKey of 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide?
The InChIKey is ZSOVBKAWDWRQGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N4O/c1-13(11-16)5-6-14(20)17-12-15(2,3)19-9-7-18(4)8-10-19/h13H,5-12,16H2,1-4H3,(H,17,20).
What are the key properties of 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide?
5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide has a molecular weight of 284.45 g/mol, XLogP of 0.50, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pentanamide is sourced from PubChem (CID 82012149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).