3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one

C16H33N3O — CID 106053081

IUPAC3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(CCCN(C)C(C)C)C1=O
InChIInChI=1S/C16H33N3O/c1-6-9-14-16(20)19(15(17-14)10-7-2)12-8-11-18(5)13(3)4/h13-15,17H,6-12H2,1-5H3
InChIKeyFITYGONAUMRHBL-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.44
Rot. Bonds9

About 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one

3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one (PubChem CID 106053081) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one.

Molecular Properties

Compound Name3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one
PubChem CID106053081
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(CCCN(C)C(C)C)C1=O
InChIInChI=1S/C16H33N3O/c1-6-9-14-16(20)19(15(17-14)10-7-2)12-8-11-18(5)13(3)4/h13-15,17H,6-12H2,1-5H3
InChIKeyFITYGONAUMRHBL-UHFFFAOYSA-N
XLogP2.44
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[3-[methyl(propan-2-yl)amino]propyl]-2-propan-2-yl-5-propylimidazolidin-4-one
CID 106053040
3-pentyl-2,5-dipropylimidazolidin-4-one
CID 83250379
5-butan-2-yl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-propylimidazolidin-4-one
CID 83253763
5-butyl-3-(4-propan-2-yloxybutyl)-2-propylimidazolidin-4-one
CID 106011093
3-(2-methylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83242304
5-butyl-3-(3-methoxypropyl)-2-propylimidazolidin-4-one
CID 83243884
3-(3-methoxypropyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83243478
5-ethyl-2-methyl-3-[4-[methyl(propan-2-yl)amino]butyl]imidazolidin-4-one
CID 83248231
2-methyl-3-[3-[methyl(propan-2-yl)amino]propyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 106053028
5-ethyl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-(2-methylpropyl)imidazolidin-4-one
CID 83253081
3-[3-(dimethylamino)propyl]-2-ethyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83250703
3-[3-[methyl(propan-2-yl)amino]propyl]-2-propyl-1,3-diazaspiro[4.4]nonan-4-one
CID 106053072

Frequently Asked Questions

What is the IUPAC name of 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one?
The IUPAC name of 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one (CID 106053081) is 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one.
What is the SMILES notation for 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one?
The canonical SMILES for 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one is CCCC1NC(CCC)N(CCCN(C)C(C)C)C1=O.
What is the InChIKey of 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one?
The InChIKey is FITYGONAUMRHBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-6-9-14-16(20)19(15(17-14)10-7-2)12-8-11-18(5)13(3)4/h13-15,17H,6-12H2,1-5H3.
What are the key properties of 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one?
3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one has a molecular weight of 283.46 g/mol, XLogP of 2.44, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[methyl(propan-2-yl)amino]propyl]-2,5-dipropylimidazolidin-4-one is sourced from PubChem (CID 106053081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).