4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one

C11H22N4O — CID 116980787

IUPAC4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one
SMILESCC1CN(CCCN2CCNCC2)C(=O)N1
InChIInChI=1S/C11H22N4O/c1-10-9-15(11(16)13-10)6-2-5-14-7-3-12-4-8-14/h10,12H,2-9H2,1H3,(H,13,16)
InChIKeyCSAHVDVXTRFBEI-UHFFFAOYSA-N
MW226.32 g/mol
LogP-0.30
Rot. Bonds4

About 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one

4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one (PubChem CID 116980787) has the molecular formula C11H22N4O and a molecular weight of 226.32 g/mol. Its IUPAC name is 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one
PubChem CID116980787
Molecular FormulaC11H22N4O
Molecular Weight226.32 g/mol
Exact Mass226.18
IUPAC Name4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one
SMILESCC1CN(CCCN2CCNCC2)C(=O)N1
InChIInChI=1S/C11H22N4O/c1-10-9-15(11(16)13-10)6-2-5-14-7-3-12-4-8-14/h10,12H,2-9H2,1H3,(H,13,16)
InChIKeyCSAHVDVXTRFBEI-UHFFFAOYSA-N
XLogP-0.30
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(3-methylazetidin-1-yl)propyl]piperazine
CID 79677275
1-(3-amino-3-methylbutyl)-4-methylimidazolidin-2-one
CID 116978853
4-methyl-1-(3-oxobutyl)imidazolidin-2-one
CID 116980530
2-(3-piperazin-1-ylpropyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 61349607
1-(hydroxymethyl)-4-methylimidazolidin-2-one
CID 19917368
1-[3-(3-tert-butylazetidin-1-yl)propyl]piperazine
CID 79677755
ethane;1-[2-(4-methylpiperidin-1-yl)ethyl]piperazine
CID 153398628
1-(3-methylsulfanylpropyl)piperazine
CID 61057069
(3aR,7aS)-2-(3-piperazin-1-ylpropyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 104963214
4-(3-methyl-5-oxopiperazin-1-yl)butanenitrile
CID 130921073
1-(3-cyclopropylsulfinylpropyl)piperazine
CID 84682171
1-[3-[(3S,4S)-3-hydroxy-4-methylpiperidin-1-yl]propyl]-3-methylpiperazin-2-one;dihydrochloride
CID 66999280

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one?
The IUPAC name of 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one (CID 116980787) is 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one.
What is the SMILES notation for 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one?
The canonical SMILES for 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one is CC1CN(CCCN2CCNCC2)C(=O)N1.
What is the InChIKey of 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one?
The InChIKey is CSAHVDVXTRFBEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O/c1-10-9-15(11(16)13-10)6-2-5-14-7-3-12-4-8-14/h10,12H,2-9H2,1H3,(H,13,16).
What are the key properties of 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one?
4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one has a molecular weight of 226.32 g/mol, XLogP of -0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(3-piperazin-1-ylpropyl)imidazolidin-2-one is sourced from PubChem (CID 116980787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).