1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one

C12H23N3O2 — CID 18340088

IUPAC1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one
SMILESCOC(C)CN1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C12H23N3O2/c1-10(17-2)9-14-6-3-11(4-7-14)15-8-5-13-12(15)16/h10-11H,3-9H2,1-2H3,(H,13,16)
InChIKeyQASHNKWXVYVRIA-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.51
Rot. Bonds4

About 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one

1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one (PubChem CID 18340088) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one
PubChem CID18340088
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one
SMILESCOC(C)CN1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C12H23N3O2/c1-10(17-2)9-14-6-3-11(4-7-14)15-8-5-13-12(15)16/h10-11H,3-9H2,1-2H3,(H,13,16)
InChIKeyQASHNKWXVYVRIA-UHFFFAOYSA-N
XLogP0.51
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one (CID 18340088) is 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one is COC(C)CN1CCC(N2CCNC2=O)CC1.
What is the InChIKey of 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one?
The InChIKey is QASHNKWXVYVRIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-10(17-2)9-14-6-3-11(4-7-14)15-8-5-13-12(15)16/h10-11H,3-9H2,1-2H3,(H,13,16).
What are the key properties of 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one?
1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one has a molecular weight of 241.33 g/mol, XLogP of 0.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxypropyl)piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 18340088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).