3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione

C10H19N3O2 — CID 82147926

IUPAC3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione
SMILESCC(C)C1(C)NC(=O)N(CCCN)C1=O
InChIInChI=1S/C10H19N3O2/c1-7(2)10(3)8(14)13(6-4-5-11)9(15)12-10/h7H,4-6,11H2,1-3H3,(H,12,15)
InChIKeyDVXGKEJDPMRYED-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.30
Rot. Bonds4

About 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione

3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione (PubChem CID 82147926) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione
PubChem CID82147926
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione
SMILESCC(C)C1(C)NC(=O)N(CCCN)C1=O
InChIInChI=1S/C10H19N3O2/c1-7(2)10(3)8(14)13(6-4-5-11)9(15)12-10/h7H,4-6,11H2,1-3H3,(H,12,15)
InChIKeyDVXGKEJDPMRYED-UHFFFAOYSA-N
XLogP0.30
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

3-(4-methyl-2,5-dioxo-4-propan-2-ylimidazolidin-1-yl)propanethioamide
CID 82148892
3-(3-aminopropyl)-5-tert-butyl-5-methylimidazolidine-2,4-dione
CID 82147925
3-(2-aminobutyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione
CID 82148488
3-(3-aminopropyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
CID 25323207
3-[2-(4-aminophenoxy)ethyl]-5-methyl-5-propan-2-ylimidazolidine-2,4-dione
CID 82149162
3-(3-aminopropyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 18071372
3-(2-aminoethyl)-5,5-dimethylimidazolidine-2,4-dione;hydrochloride
CID 14008501
(5S)-5-methyl-3-[[(2S)-oxolan-2-yl]methyl]-5-propan-2-ylimidazolidine-2,4-dione
CID 124881230
3-(4-aminobutyl)-1,3-diazaspiro[4.4]nonane-2,4-dione;hydrochloride
CID 75481374
(5S)-3-[(3-fluorophenyl)methyl]-5-methyl-5-propan-2-ylimidazolidine-2,4-dione
CID 94191065
(5S)-3-[(2S)-2-hydroxy-3-phenoxypropyl]-5-methyl-5-propan-2-ylimidazolidine-2,4-dione
CID 94389915
1,3-bis(3-aminopropyl)-5,5-dimethyl-1,3-diazinane-2,4-dione
CID 154146369

Frequently Asked Questions

What is the IUPAC name of 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione?
The IUPAC name of 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione (CID 82147926) is 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione?
The canonical SMILES for 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione is CC(C)C1(C)NC(=O)N(CCCN)C1=O.
What is the InChIKey of 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione?
The InChIKey is DVXGKEJDPMRYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-7(2)10(3)8(14)13(6-4-5-11)9(15)12-10/h7H,4-6,11H2,1-3H3,(H,12,15).
What are the key properties of 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione?
3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione has a molecular weight of 213.28 g/mol, XLogP of 0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminopropyl)-5-methyl-5-propan-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 82147926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).