(2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine

C12H18N2 — CID 121449628

IUPAC(2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine
SMILESCc1ccccc1N1CCN(C)[C@@H]1C
InChIInChI=1S/C12H18N2/c1-10-6-4-5-7-12(10)14-9-8-13(3)11(14)2/h4-7,11H,8-9H2,1-3H3/t11-/m0/s1
InChIKeyUCMPUTZPKSIAGO-NSHDSACASA-N
MW190.29 g/mol
LogP2.09
Rot. Bonds1

About (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine

(2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine (PubChem CID 121449628) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine.

Molecular Properties

Compound Name(2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine
PubChem CID121449628
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name(2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine
SMILESCc1ccccc1N1CCN(C)[C@@H]1C
InChIInChI=1S/C12H18N2/c1-10-6-4-5-7-12(10)14-9-8-13(3)11(14)2/h4-7,11H,8-9H2,1-3H3/t11-/m0/s1
InChIKeyUCMPUTZPKSIAGO-NSHDSACASA-N
XLogP2.09
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine?
The IUPAC name of (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine (CID 121449628) is (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine.
What is the SMILES notation for (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine?
The canonical SMILES for (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine is Cc1ccccc1N1CCN(C)[C@@H]1C.
What is the InChIKey of (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine?
The InChIKey is UCMPUTZPKSIAGO-NSHDSACASA-N. The full InChI is InChI=1S/C12H18N2/c1-10-6-4-5-7-12(10)14-9-8-13(3)11(14)2/h4-7,11H,8-9H2,1-3H3/t11-/m0/s1.
What are the key properties of (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine?
(2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine has a molecular weight of 190.29 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1,2-dimethyl-3-(2-methylphenyl)imidazolidine is sourced from PubChem (CID 121449628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).