5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione

C11H14N2O2 — CID 143510283

IUPAC5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione
SMILESC=C/C=C(C)\C=C/CC1NC(=O)NC1=O
InChIInChI=1S/C11H14N2O2/c1-3-5-8(2)6-4-7-9-10(14)13-11(15)12-9/h3-6,9H,1,7H2,2H3,(H2,12,13,14,15)/b6-4-,8-5-
InChIKeyMTMMYXYNTZNVND-VXWIUBPCSA-N
MW206.24 g/mol
LogP1.27
Rot. Bonds4

About 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione

5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione (PubChem CID 143510283) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione
PubChem CID143510283
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione
SMILESC=C/C=C(C)\C=C/CC1NC(=O)NC1=O
InChIInChI=1S/C11H14N2O2/c1-3-5-8(2)6-4-7-9-10(14)13-11(15)12-9/h3-6,9H,1,7H2,2H3,(H2,12,13,14,15)/b6-4-,8-5-
InChIKeyMTMMYXYNTZNVND-VXWIUBPCSA-N
XLogP1.27
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione with MolForge

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Related Compounds

(3Z)-4-methylocta-1,3,5-triene
CID 142968936
3-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]piperidine
CID 143938977
(3Z,5Z)-7-fluoro-4-methylhepta-1,3,5-triene
CID 118002257
5-propylimidazolidine-2,4-dione
CID 567619
5-prop-1-en-2-ylimidazolidine-2,4-dione
CID 152892368
3-(2,5-dioxoimidazolidin-4-yl)-2-methylpropanoic acid
CID 121449082
(2Z,4Z)-4-methylhepta-2,4,6-triene-1-sulfonic acid
CID 90448370
(3Z,5Z)-7-methoxy-4-methylhepta-1,3,5-triene
CID 89381358
(5R)-5-butylimidazolidine-2,4-dione
CID 51416195
(5S)-5-(methylsulfonylmethyl)imidazolidine-2,4-dione
CID 59794401
methyl 3-(2,5-dioxoimidazolidin-4-yl)-2-methylpropanoate
CID 137467945
N-[3-[(4S)-2,5-dioxoimidazolidin-4-yl]propyl]acetamide
CID 99868106

Frequently Asked Questions

What is the IUPAC name of 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione?
The IUPAC name of 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione (CID 143510283) is 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione is C=C/C=C(C)\C=C/CC1NC(=O)NC1=O.
What is the InChIKey of 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione?
The InChIKey is MTMMYXYNTZNVND-VXWIUBPCSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-3-5-8(2)6-4-7-9-10(14)13-11(15)12-9/h3-6,9H,1,7H2,2H3,(H2,12,13,14,15)/b6-4-,8-5-.
What are the key properties of 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione?
5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione has a molecular weight of 206.24 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2Z,4Z)-4-methylhepta-2,4,6-trienyl]imidazolidine-2,4-dione is sourced from PubChem (CID 143510283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).