1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine

C18H26N2 — CID 155105265

IUPAC1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine
SMILESCC1=CC[C@@H](N2CCN(c3c(C)cc(C)cc3C)C2)C1
InChIInChI=1S/C18H26N2/c1-13-5-6-17(11-13)19-7-8-20(12-19)18-15(3)9-14(2)10-16(18)4/h5,9-10,17H,6-8,11-12H2,1-4H3/t17-/m1/s1
InChIKeyBMKRNYWXJQBZAK-QGZVFWFLSA-N
MW270.42 g/mol
LogP3.80
Rot. Bonds2

About 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine

1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine (PubChem CID 155105265) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine.

Molecular Properties

Compound Name1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine
PubChem CID155105265
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine
SMILESCC1=CC[C@@H](N2CCN(c3c(C)cc(C)cc3C)C2)C1
InChIInChI=1S/C18H26N2/c1-13-5-6-17(11-13)19-7-8-20(12-19)18-15(3)9-14(2)10-16(18)4/h5,9-10,17H,6-8,11-12H2,1-4H3/t17-/m1/s1
InChIKeyBMKRNYWXJQBZAK-QGZVFWFLSA-N
XLogP3.80
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine?
The IUPAC name of 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine (CID 155105265) is 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine.
What is the SMILES notation for 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine?
The canonical SMILES for 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine is CC1=CC[C@@H](N2CCN(c3c(C)cc(C)cc3C)C2)C1.
What is the InChIKey of 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine?
The InChIKey is BMKRNYWXJQBZAK-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H26N2/c1-13-5-6-17(11-13)19-7-8-20(12-19)18-15(3)9-14(2)10-16(18)4/h5,9-10,17H,6-8,11-12H2,1-4H3/t17-/m1/s1.
What are the key properties of 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine?
1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine has a molecular weight of 270.42 g/mol, XLogP of 3.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-3-methylcyclopent-3-en-1-yl]-3-(2,4,6-trimethylphenyl)imidazolidine is sourced from PubChem (CID 155105265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).