1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine

C25H28N2 — CID 123208139

IUPAC1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine
SMILESC[C@@H]1C=c2c(N3CCN(C4=c5ccccc5=CC[C@H]4C)C3)cccc2=CC1
InChIInChI=1S/C25H28N2/c1-18-10-12-21-7-5-9-24(23(21)16-18)26-14-15-27(17-26)25-19(2)11-13-20-6-3-4-8-22(20)25/h3-9,12-13,16,18-19H,10-11,14-15,17H2,1-2H3/t18-,19+/m0/s1
InChIKeyVFLFYILGEVJBCW-RBUKOAKNSA-N
MW356.51 g/mol
LogP2.00
Rot. Bonds2

About 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine

1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine (PubChem CID 123208139) has the molecular formula C25H28N2 and a molecular weight of 356.51 g/mol. Its IUPAC name is 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine.

Molecular Properties

Compound Name1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine
PubChem CID123208139
Molecular FormulaC25H28N2
Molecular Weight356.51 g/mol
Exact Mass356.23
IUPAC Name1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine
SMILESC[C@@H]1C=c2c(N3CCN(C4=c5ccccc5=CC[C@H]4C)C3)cccc2=CC1
InChIInChI=1S/C25H28N2/c1-18-10-12-21-7-5-9-24(23(21)16-18)26-14-15-27(17-26)25-19(2)11-13-20-6-3-4-8-22(20)25/h3-9,12-13,16,18-19H,10-11,14-15,17H2,1-2H3/t18-,19+/m0/s1
InChIKeyVFLFYILGEVJBCW-RBUKOAKNSA-N
XLogP2.00
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.51
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine?
The IUPAC name of 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine (CID 123208139) is 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine.
What is the SMILES notation for 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine?
The canonical SMILES for 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine is C[C@@H]1C=c2c(N3CCN(C4=c5ccccc5=CC[C@H]4C)C3)cccc2=CC1.
What is the InChIKey of 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine?
The InChIKey is VFLFYILGEVJBCW-RBUKOAKNSA-N. The full InChI is InChI=1S/C25H28N2/c1-18-10-12-21-7-5-9-24(23(21)16-18)26-14-15-27(17-26)25-19(2)11-13-20-6-3-4-8-22(20)25/h3-9,12-13,16,18-19H,10-11,14-15,17H2,1-2H3/t18-,19+/m0/s1.
What are the key properties of 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine?
1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine has a molecular weight of 356.51 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-methyl-2,3-dihydronaphthalen-1-yl]-3-[(7S)-7-methyl-6,7-dihydronaphthalen-1-yl]imidazolidine is sourced from PubChem (CID 123208139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).