4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one

C26H50N4O2 — CID 54328687

IUPAC4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one
SMILESCCCCN(CCCC)Cn1c(O)c(C2CCCC2)n(CN(CCCC)CCCC)c1=O
InChIInChI=1S/C26H50N4O2/c1-5-9-17-27(18-10-6-2)21-29-24(23-15-13-14-16-23)25(31)30(26(29)32)22-28(19-11-7-3)20-12-8-4/h23,31H,5-22H2,1-4H3
InChIKeySWTYNMUEPBZBLR-UHFFFAOYSA-N
MW450.71 g/mol
LogP5.73
Rot. Bonds17

About 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one

4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one (PubChem CID 54328687) has the molecular formula C26H50N4O2 and a molecular weight of 450.71 g/mol. Its IUPAC name is 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one.

Molecular Properties

Compound Name4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one
PubChem CID54328687
Molecular FormulaC26H50N4O2
Molecular Weight450.71 g/mol
Exact Mass450.39
IUPAC Name4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one
SMILESCCCCN(CCCC)Cn1c(O)c(C2CCCC2)n(CN(CCCC)CCCC)c1=O
InChIInChI=1S/C26H50N4O2/c1-5-9-17-27(18-10-6-2)21-29-24(23-15-13-14-16-23)25(31)30(26(29)32)22-28(19-11-7-3)20-12-8-4/h23,31H,5-22H2,1-4H3
InChIKeySWTYNMUEPBZBLR-UHFFFAOYSA-N
XLogP5.73
TPSA53.64 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.71
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-bis[(didodecylamino)methyl]-4-hydroxyimidazol-2-one
CID 54036253
ethane;1,3,5-tris[3-(dibutylamino)-2-hydroxypropyl]-1,3,5-triazinane-2,4,6-trione
CID 142609428
(1S,2R,6S,7R)-4-[[butyl-[[(1R,2S,6R,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]methyl]amino]methyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 98056179
2-[[butyl(ethyl)amino]methyl]cyclopentan-1-one
CID 62611855
N',N'-dibutyl-N-cyclopentylpropane-1,3-diamine
CID 55087820
2-[[butyl(ethyl)amino]methyl]-1-cycloheptyl-5-hydroxypyridin-4-one
CID 94960137
N',N'-dibutyl-N-(cyclopentylmethyl)ethane-1,2-diamine
CID 63503881
N,N-dibutylbutan-1-amine;hydrogen peroxide
CID 87070191
1-[2-[butyl(methyl)amino]-2-oxoethyl]-5-cyclobutyltriazole-4-carboxylic acid
CID 82202464
1-cyclopentyl-2-[(dipropylamino)methyl]-3-hydroxy-6-methylpyridin-4-one
CID 94958996
N-butyl-N-propylcyclohexanamine
CID 15751893
2-[[butyl(methyl)amino]methyl]-1-cyclopentyl-5-hydroxypyridin-4-one
CID 82218438

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one?
The IUPAC name of 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one (CID 54328687) is 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one.
What is the SMILES notation for 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one?
The canonical SMILES for 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one is CCCCN(CCCC)Cn1c(O)c(C2CCCC2)n(CN(CCCC)CCCC)c1=O.
What is the InChIKey of 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one?
The InChIKey is SWTYNMUEPBZBLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H50N4O2/c1-5-9-17-27(18-10-6-2)21-29-24(23-15-13-14-16-23)25(31)30(26(29)32)22-28(19-11-7-3)20-12-8-4/h23,31H,5-22H2,1-4H3.
What are the key properties of 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one?
4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one has a molecular weight of 450.71 g/mol, XLogP of 5.73, 17 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-1,3-bis[(dibutylamino)methyl]-5-hydroxyimidazol-2-one is sourced from PubChem (CID 54328687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).