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

C14H29N3O — CID 114140888

IUPAC5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one
SMILESCCC1(C)NC(C)N(CCCN(C)C(C)C)C1=O
InChIInChI=1S/C14H29N3O/c1-7-14(5)13(18)17(12(4)15-14)10-8-9-16(6)11(2)3/h11-12,15H,7-10H2,1-6H3
InChIKeyUKDFRAQXWRNPEW-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.66
Rot. Bonds6

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

5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one (PubChem CID 114140888) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one
PubChem CID114140888
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one
SMILESCCC1(C)NC(C)N(CCCN(C)C(C)C)C1=O
InChIInChI=1S/C14H29N3O/c1-7-14(5)13(18)17(12(4)15-14)10-8-9-16(6)11(2)3/h11-12,15H,7-10H2,1-6H3
InChIKeyUKDFRAQXWRNPEW-UHFFFAOYSA-N
XLogP1.66
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Isopropylhydantoin
CID 103033
AC1Lgxvo
CID 853633
(5R)-5-(propan-2-yl)imidazolidine-2,4-dione
CID 853634
3-Cyclopentyl-5-isopropyl-imidazolidine-2,4-dione
CID 5273848
Hydantoin, 3-(3-(dimethylamino)propyl)-5-isopropyl-2-thio-
CID 3070456
Hydantoin, 3-(3-(diethylamino)propyl)-5-isopropyl-2-thio-
CID 3070460
3-(2-(Diethylamino)ethyl)-5,5-dimethylhydantoin
CID 3028666
3-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)propyl-trimethylazanium chloride
CID 155562366
2-tert-Butyl-3,5-dimethyl-4-imidazolidinone, (2R,5S)-
CID 44190959
3-Methyl-5-isopropylhydantoin
CID 53425842
3-Butyl-5-methylimidazolidine-2,4-dione
CID 335477
3-(2-(Dimethylamino)ethyl)-5,5-dimethylhydantoin
CID 298086

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one?
The IUPAC name of 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one (CID 114140888) is 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one?
The canonical SMILES for 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one is CCC1(C)NC(C)N(CCCN(C)C(C)C)C1=O.
What is the InChIKey of 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one?
The InChIKey is UKDFRAQXWRNPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-7-14(5)13(18)17(12(4)15-14)10-8-9-16(6)11(2)3/h11-12,15H,7-10H2,1-6H3.
What are the key properties of 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one?
5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one has a molecular weight of 255.41 g/mol, XLogP of 1.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,5-dimethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one is sourced from PubChem (CID 114140888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).