1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine

C14H22N2 — CID 122596955

IUPAC1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine
SMILESC=CC1=C[C@@H](C)[C@@H](N2CCNC2C)C(C)=C1
InChIInChI=1S/C14H22N2/c1-5-13-8-10(2)14(11(3)9-13)16-7-6-15-12(16)4/h5,8-10,12,14-15H,1,6-7H2,2-4H3/t10-,12?,14-/m1/s1
InChIKeyRUYNGMCVJIUXKP-GYYYEOQOSA-N
MW218.34 g/mol
LogP2.31
Rot. Bonds2

About 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine

1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine (PubChem CID 122596955) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine.

Molecular Properties

Compound Name1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine
PubChem CID122596955
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine
SMILESC=CC1=C[C@@H](C)[C@@H](N2CCNC2C)C(C)=C1
InChIInChI=1S/C14H22N2/c1-5-13-8-10(2)14(11(3)9-13)16-7-6-15-12(16)4/h5,8-10,12,14-15H,1,6-7H2,2-4H3/t10-,12?,14-/m1/s1
InChIKeyRUYNGMCVJIUXKP-GYYYEOQOSA-N
XLogP2.31
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine 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 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine?
The IUPAC name of 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine (CID 122596955) is 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine.
What is the SMILES notation for 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine?
The canonical SMILES for 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine is C=CC1=C[C@@H](C)[C@@H](N2CCNC2C)C(C)=C1.
What is the InChIKey of 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine?
The InChIKey is RUYNGMCVJIUXKP-GYYYEOQOSA-N. The full InChI is InChI=1S/C14H22N2/c1-5-13-8-10(2)14(11(3)9-13)16-7-6-15-12(16)4/h5,8-10,12,14-15H,1,6-7H2,2-4H3/t10-,12?,14-/m1/s1.
What are the key properties of 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine?
1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine has a molecular weight of 218.34 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R,6R)-4-ethenyl-2,6-dimethylcyclohexa-2,4-dien-1-yl]-2-methylimidazolidine is sourced from PubChem (CID 122596955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).