(Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide

C12H21N3O2 — CID 143593265

IUPAC(Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide
SMILESC=C(/C=C\C)CCC.NC(=O)C1CNC(=O)N1
InChIInChI=1S/C8H14.C4H7N3O2/c1-4-6-8(3)7-5-2;5-3(8)2-1-6-4(9)7-2/h4,6H,3,5,7H2,1-2H3;2H,1H2,(H2,5,8)(H2,6,7,9)/b6-4-;
InChIKeyKJADPTQVWAFUBC-YHSAGPEESA-N
MW239.32 g/mol
LogP1.07
Rot. Bonds4

About (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide

(Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide (PubChem CID 143593265) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide.

Molecular Properties

Compound Name(Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide
PubChem CID143593265
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name(Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide
SMILESC=C(/C=C\C)CCC.NC(=O)C1CNC(=O)N1
InChIInChI=1S/C8H14.C4H7N3O2/c1-4-6-8(3)7-5-2;5-3(8)2-1-6-4(9)7-2/h4,6H,3,5,7H2,1-2H3;2H,1H2,(H2,5,8)(H2,6,7,9)/b6-4-;
InChIKeyKJADPTQVWAFUBC-YHSAGPEESA-N
XLogP1.07
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 51.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide?
The IUPAC name of (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide (CID 143593265) is (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide.
What is the SMILES notation for (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide?
The canonical SMILES for (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide is C=C(/C=C\C)CCC.NC(=O)C1CNC(=O)N1.
What is the InChIKey of (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide?
The InChIKey is KJADPTQVWAFUBC-YHSAGPEESA-N. The full InChI is InChI=1S/C8H14.C4H7N3O2/c1-4-6-8(3)7-5-2;5-3(8)2-1-6-4(9)7-2/h4,6H,3,5,7H2,1-2H3;2H,1H2,(H2,5,8)(H2,6,7,9)/b6-4-;.
What are the key properties of (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide?
(Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide has a molecular weight of 239.32 g/mol, XLogP of 1.07, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-methylidenehept-2-ene;2-oxoimidazolidine-4-carboxamide is sourced from PubChem (CID 143593265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).