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

C12H22N4O2 — CID 54872429

IUPAC1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one
SMILESNCCCC(=O)N1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C12H22N4O2/c13-5-1-2-11(17)15-7-3-10(4-8-15)16-9-6-14-12(16)18/h10H,1-9,13H2,(H,14,18)
InChIKeyLITLZGPNENHLQP-UHFFFAOYSA-N
MW254.33 g/mol
LogP-0.26
Rot. Bonds4

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

1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one (PubChem CID 54872429) has the molecular formula C12H22N4O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one
PubChem CID54872429
Molecular FormulaC12H22N4O2
Molecular Weight254.33 g/mol
Exact Mass254.17
IUPAC Name1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one
SMILESNCCCC(=O)N1CCC(N2CCNC2=O)CC1
InChIInChI=1S/C12H22N4O2/c13-5-1-2-11(17)15-7-3-10(4-8-15)16-9-6-14-12(16)18/h10H,1-9,13H2,(H,14,18)
InChIKeyLITLZGPNENHLQP-UHFFFAOYSA-N
XLogP-0.26
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-[2-(methylamino)acetyl]piperidin-4-yl]imidazolidin-2-one
CID 54872430
7-(4-aminobutanoyl)-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 79091744
1-[1-[1-(aminomethyl)cyclobutanecarbonyl]piperidin-4-yl]imidazolidin-2-one
CID 115448111
1-[1-[3-(4-methylpyrazol-1-yl)propanoyl]piperidin-4-yl]imidazolidin-2-one
CID 56817622
3-[2-oxo-2-[4-(2-oxoimidazolidin-1-yl)piperidin-1-yl]ethyl]-1,3-thiazolidin-4-one
CID 56797721
1-[1-(4-aminocyclohexanecarbonyl)piperidin-4-yl]imidazolidin-2-one
CID 60947074
1-[1-[2-[4-(trifluoromethyl)phenyl]acetyl]piperidin-4-yl]imidazolidin-2-one
CID 155234103
1-[1-(2-bromo-2-methylpropanoyl)piperidin-4-yl]imidazolidin-2-one
CID 114328233
1-[1-[3-[5-[(1S,2R)-2-methylcyclopropyl]furan-2-yl]propanoyl]piperidin-4-yl]imidazolidin-2-one
CID 94628029
1-[1-[3-[5-(2-methylcyclopropyl)furan-2-yl]propanoyl]piperidin-4-yl]imidazolidin-2-one
CID 56816833
2-(4-aminobutanoyl)-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82863221
4-amino-1-(3-fluoropyrrolidin-1-yl)butan-1-one
CID 83854045

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one (CID 54872429) is 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one is NCCCC(=O)N1CCC(N2CCNC2=O)CC1.
What is the InChIKey of 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one?
The InChIKey is LITLZGPNENHLQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O2/c13-5-1-2-11(17)15-7-3-10(4-8-15)16-9-6-14-12(16)18/h10H,1-9,13H2,(H,14,18).
What are the key properties of 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one?
1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one has a molecular weight of 254.33 g/mol, XLogP of -0.26, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-aminobutanoyl)piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 54872429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).