(2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine

C11H16N2O — CID 89230027

IUPAC(2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine
SMILESCOC[C@@H]1CN[C@@H](c2ccccc2)N1
InChIInChI=1S/C11H16N2O/c1-14-8-10-7-12-11(13-10)9-5-3-2-4-6-9/h2-6,10-13H,7-8H2,1H3/t10-,11+/m0/s1
InChIKeyQMBDYDGLPSWTNR-WDEREUQCSA-N
MW192.26 g/mol
LogP0.89
Rot. Bonds3

About (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine

(2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine (PubChem CID 89230027) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine.

Molecular Properties

Compound Name(2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine
PubChem CID89230027
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name(2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine
SMILESCOC[C@@H]1CN[C@@H](c2ccccc2)N1
InChIInChI=1S/C11H16N2O/c1-14-8-10-7-12-11(13-10)9-5-3-2-4-6-9/h2-6,10-13H,7-8H2,1H3/t10-,11+/m0/s1
InChIKeyQMBDYDGLPSWTNR-WDEREUQCSA-N
XLogP0.89
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine?
The IUPAC name of (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine (CID 89230027) is (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine.
What is the SMILES notation for (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine?
The canonical SMILES for (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine is COC[C@@H]1CN[C@@H](c2ccccc2)N1.
What is the InChIKey of (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine?
The InChIKey is QMBDYDGLPSWTNR-WDEREUQCSA-N. The full InChI is InChI=1S/C11H16N2O/c1-14-8-10-7-12-11(13-10)9-5-3-2-4-6-9/h2-6,10-13H,7-8H2,1H3/t10-,11+/m0/s1.
What are the key properties of (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine?
(2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine has a molecular weight of 192.26 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S)-4-(methoxymethyl)-2-phenylimidazolidine is sourced from PubChem (CID 89230027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).