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

C15H30N4O — CID 63854326

IUPAC1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one
SMILESCCCNC(C)C1CCN(CCN2CCNC2=O)CC1
InChIInChI=1S/C15H30N4O/c1-3-6-16-13(2)14-4-8-18(9-5-14)11-12-19-10-7-17-15(19)20/h13-14,16H,3-12H2,1-2H3,(H,17,20)
InChIKeyQUUODKIAWXHLAK-UHFFFAOYSA-N
MW282.43 g/mol
LogP1.11
Rot. Bonds7

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

1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one (PubChem CID 63854326) has the molecular formula C15H30N4O and a molecular weight of 282.43 g/mol. Its IUPAC name is 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one
PubChem CID63854326
Molecular FormulaC15H30N4O
Molecular Weight282.43 g/mol
Exact Mass282.24
IUPAC Name1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one
SMILESCCCNC(C)C1CCN(CCN2CCNC2=O)CC1
InChIInChI=1S/C15H30N4O/c1-3-6-16-13(2)14-4-8-18(9-5-14)11-12-19-10-7-17-15(19)20/h13-14,16H,3-12H2,1-2H3,(H,17,20)
InChIKeyQUUODKIAWXHLAK-UHFFFAOYSA-N
XLogP1.11
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The IUPAC name of 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one (CID 63854326) is 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The canonical SMILES for 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one is CCCNC(C)C1CCN(CCN2CCNC2=O)CC1.
What is the InChIKey of 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one?
The InChIKey is QUUODKIAWXHLAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O/c1-3-6-16-13(2)14-4-8-18(9-5-14)11-12-19-10-7-17-15(19)20/h13-14,16H,3-12H2,1-2H3,(H,17,20).
What are the key properties of 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one?
1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one has a molecular weight of 282.43 g/mol, XLogP of 1.11, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-[1-(propylamino)ethyl]piperidin-1-yl]ethyl]imidazolidin-2-one is sourced from PubChem (CID 63854326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).