(4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one

C16H24N2O — CID 90160775

IUPAC(4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one
SMILESCC(C)(C)[C@H]1CN(C2C=C3C4CC3CC2C4)C(=O)N1
InChIInChI=1S/C16H24N2O/c1-16(2,3)14-8-18(15(19)17-14)13-7-12-9-4-10(12)6-11(13)5-9/h7,9-11,13-14H,4-6,8H2,1-3H3,(H,17,19)/t9?,10?,11?,13?,14-/m1/s1
InChIKeyHGOAHFJMXHOAED-ANUKEEOOSA-N
MW260.38 g/mol
LogP2.78
Rot. Bonds1

About (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one

(4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one (PubChem CID 90160775) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one.

Molecular Properties

Compound Name(4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one
PubChem CID90160775
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name(4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one
SMILESCC(C)(C)[C@H]1CN(C2C=C3C4CC3CC2C4)C(=O)N1
InChIInChI=1S/C16H24N2O/c1-16(2,3)14-8-18(15(19)17-14)13-7-12-9-4-10(12)6-11(13)5-9/h7,9-11,13-14H,4-6,8H2,1-3H3,(H,17,19)/t9?,10?,11?,13?,14-/m1/s1
InChIKeyHGOAHFJMXHOAED-ANUKEEOOSA-N
XLogP2.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one 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 (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one?
The IUPAC name of (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one (CID 90160775) is (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one.
What is the SMILES notation for (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one?
The canonical SMILES for (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one is CC(C)(C)[C@H]1CN(C2C=C3C4CC3CC2C4)C(=O)N1.
What is the InChIKey of (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one?
The InChIKey is HGOAHFJMXHOAED-ANUKEEOOSA-N. The full InChI is InChI=1S/C16H24N2O/c1-16(2,3)14-8-18(15(19)17-14)13-7-12-9-4-10(12)6-11(13)5-9/h7,9-11,13-14H,4-6,8H2,1-3H3,(H,17,19)/t9?,10?,11?,13?,14-/m1/s1.
What are the key properties of (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one?
(4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one has a molecular weight of 260.38 g/mol, XLogP of 2.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-tert-butyl-1-(4-tricyclo[3.3.1.02,7]non-2-enyl)imidazolidin-2-one is sourced from PubChem (CID 90160775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).