methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione

C13H26N4O2 — CID 160883463

IUPACmethane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione
SMILESC.CN1CCN(CCCN2C(=O)CN(C)C2=O)CC1
InChIInChI=1S/C12H22N4O2.CH4/c1-13-6-8-15(9-7-13)4-3-5-16-11(17)10-14(2)12(16)18;/h3-10H2,1-2H3;1H4
InChIKeySNIDAHKKILANDP-UHFFFAOYSA-N
MW270.38 g/mol
LogP0.15
Rot. Bonds4

About methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione

methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione (PubChem CID 160883463) has the molecular formula C13H26N4O2 and a molecular weight of 270.38 g/mol. Its IUPAC name is methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Namemethane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione
PubChem CID160883463
Molecular FormulaC13H26N4O2
Molecular Weight270.38 g/mol
Exact Mass270.21
IUPAC Namemethane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione
SMILESC.CN1CCN(CCCN2C(=O)CN(C)C2=O)CC1
InChIInChI=1S/C12H22N4O2.CH4/c1-13-6-8-15(9-7-13)4-3-5-16-11(17)10-14(2)12(16)18;/h3-10H2,1-2H3;1H4
InChIKeySNIDAHKKILANDP-UHFFFAOYSA-N
XLogP0.15
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 50.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione?
The IUPAC name of methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione (CID 160883463) is methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione.
What is the SMILES notation for methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione?
The canonical SMILES for methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione is C.CN1CCN(CCCN2C(=O)CN(C)C2=O)CC1.
What is the InChIKey of methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione?
The InChIKey is SNIDAHKKILANDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2.CH4/c1-13-6-8-15(9-7-13)4-3-5-16-11(17)10-14(2)12(16)18;/h3-10H2,1-2H3;1H4.
What are the key properties of methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione?
methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione has a molecular weight of 270.38 g/mol, XLogP of 0.15, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-methyl-3-[3-(4-methylpiperazin-1-yl)propyl]imidazolidine-2,4-dione is sourced from PubChem (CID 160883463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).