N-(4-methylpiperazin-1-yl)butanamide

C9H19N3O — CID 4129194

IUPACN-(4-methylpiperazin-1-yl)butanamide
SMILESCCCC(=O)NN1CCN(C)CC1
InChIInChI=1S/C9H19N3O/c1-3-4-9(13)10-12-7-5-11(2)6-8-12/h3-8H2,1-2H3,(H,10,13)
InChIKeyJLNLOZGWSMRNDP-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.07
Rot. Bonds3

About N-(4-methylpiperazin-1-yl)butanamide

N-(4-methylpiperazin-1-yl)butanamide (PubChem CID 4129194) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is N-(4-methylpiperazin-1-yl)butanamide.

Molecular Properties

Compound NameN-(4-methylpiperazin-1-yl)butanamide
PubChem CID4129194
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC NameN-(4-methylpiperazin-1-yl)butanamide
SMILESCCCC(=O)NN1CCN(C)CC1
InChIInChI=1S/C9H19N3O/c1-3-4-9(13)10-12-7-5-11(2)6-8-12/h3-8H2,1-2H3,(H,10,13)
InChIKeyJLNLOZGWSMRNDP-UHFFFAOYSA-N
XLogP0.07
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylpiperazin-1-yl)dodecanamide
CID 3590549
N-(azepan-1-yl)butanamide
CID 67379865
2-cyano-N-(4-methylpiperazin-1-yl)acetamide
CID 3643961
N-(4-pyrimidin-2-ylpiperazin-1-yl)butanamide
CID 154467399
2-(2-hydroxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide
CID 83016661
3-(4-methylphenoxy)-N-(4-methylpiperazin-1-yl)propanamide
CID 9205006
3-methyl-5-[(4-methylpiperazin-1-yl)amino]-5-oxopentanoic acid
CID 83005393
N-(3,3-dimethyl-2-oxopyrrolidin-1-yl)butanamide
CID 139797965
3-(4-fluorophenyl)sulfonyl-N-(4-methylpiperazin-1-yl)propanamide
CID 9205248
N-(4-methylpiperazin-1-yl)-3-[5-[3-[3-[(4-methylpiperazin-1-yl)amino]-3-oxopropyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanamide
CID 4756080
3-(1H-indol-3-yl)-N-(4-methylpiperazin-1-yl)propanamide
CID 78909578
2-(2-methoxyethylamino)-N-(4-methylpiperazin-1-yl)acetamide
CID 83015861

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperazin-1-yl)butanamide?
The IUPAC name of N-(4-methylpiperazin-1-yl)butanamide (CID 4129194) is N-(4-methylpiperazin-1-yl)butanamide.
What is the SMILES notation for N-(4-methylpiperazin-1-yl)butanamide?
The canonical SMILES for N-(4-methylpiperazin-1-yl)butanamide is CCCC(=O)NN1CCN(C)CC1.
What is the InChIKey of N-(4-methylpiperazin-1-yl)butanamide?
The InChIKey is JLNLOZGWSMRNDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-3-4-9(13)10-12-7-5-11(2)6-8-12/h3-8H2,1-2H3,(H,10,13).
What are the key properties of N-(4-methylpiperazin-1-yl)butanamide?
N-(4-methylpiperazin-1-yl)butanamide has a molecular weight of 185.27 g/mol, XLogP of 0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperazin-1-yl)butanamide is sourced from PubChem (CID 4129194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).