3-benzyl-2,2-dipropylimidazolidin-4-one

C16H24N2O — CID 122605923

IUPAC3-benzyl-2,2-dipropylimidazolidin-4-one
SMILESCCCC1(CCC)NCC(=O)N1Cc1ccccc1
InChIInChI=1S/C16H24N2O/c1-3-10-16(11-4-2)17-12-15(19)18(16)13-14-8-6-5-7-9-14/h5-9,17H,3-4,10-13H2,1-2H3
InChIKeyRJTPWKONJIJTBO-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.91
Rot. Bonds6

About 3-benzyl-2,2-dipropylimidazolidin-4-one

3-benzyl-2,2-dipropylimidazolidin-4-one (PubChem CID 122605923) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-benzyl-2,2-dipropylimidazolidin-4-one.

Molecular Properties

Compound Name3-benzyl-2,2-dipropylimidazolidin-4-one
PubChem CID122605923
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name3-benzyl-2,2-dipropylimidazolidin-4-one
SMILESCCCC1(CCC)NCC(=O)N1Cc1ccccc1
InChIInChI=1S/C16H24N2O/c1-3-10-16(11-4-2)17-12-15(19)18(16)13-14-8-6-5-7-9-14/h5-9,17H,3-4,10-13H2,1-2H3
InChIKeyRJTPWKONJIJTBO-UHFFFAOYSA-N
XLogP2.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 57433089
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CID 46195333
1-benzyl-4-imino-5-methyl-5-propylimidazolidin-2-one
CID 138390340
3-ethyl-2-methyl-2-propylimidazolidin-4-one
CID 130684335
(4R)-4-(2-aminoethyl)-1-benzyl-4-methylazetidin-2-one;methane
CID 142384259
1-benzyl-6-methoxy-6-(2-methylpropyl)piperazine-2,5-dione
CID 15914230
2-benzyl-4-methyl-4-propyl-1,2,5-thiadiazolidin-3-one
CID 56984937
(3R,4S)-1-benzyl-3-chloro-4-(2-chloropropan-2-yl)-3-propylpyrrolidin-2-one
CID 100987573
1-benzyl-4-imino-5-methyl-5-pentylimidazolidin-2-one
CID 138391184
3-benzyl-5,5-diethylimidazolidine-2,4-dione
CID 7181081
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CID 163217166

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-2,2-dipropylimidazolidin-4-one?
The IUPAC name of 3-benzyl-2,2-dipropylimidazolidin-4-one (CID 122605923) is 3-benzyl-2,2-dipropylimidazolidin-4-one.
What is the SMILES notation for 3-benzyl-2,2-dipropylimidazolidin-4-one?
The canonical SMILES for 3-benzyl-2,2-dipropylimidazolidin-4-one is CCCC1(CCC)NCC(=O)N1Cc1ccccc1.
What is the InChIKey of 3-benzyl-2,2-dipropylimidazolidin-4-one?
The InChIKey is RJTPWKONJIJTBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-3-10-16(11-4-2)17-12-15(19)18(16)13-14-8-6-5-7-9-14/h5-9,17H,3-4,10-13H2,1-2H3.
What are the key properties of 3-benzyl-2,2-dipropylimidazolidin-4-one?
3-benzyl-2,2-dipropylimidazolidin-4-one has a molecular weight of 260.38 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-2,2-dipropylimidazolidin-4-one is sourced from PubChem (CID 122605923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).