3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine

C22H23N3 — CID 827711

IUPAC3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine
SMILESCc1cccc(N2CCN(c3cccc(C)c3)C2c2cccnc2)c1
InChIInChI=1S/C22H23N3/c1-17-6-3-9-20(14-17)24-12-13-25(21-10-4-7-18(2)15-21)22(24)19-8-5-11-23-16-19/h3-11,14-16,22H,12-13H2,1-2H3
InChIKeyFVAZFFGPGLNAPD-UHFFFAOYSA-N
MW329.45 g/mol
LogP4.72
Rot. Bonds3

About 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine

3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine (PubChem CID 827711) has the molecular formula C22H23N3 and a molecular weight of 329.45 g/mol. Its IUPAC name is 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine.

Molecular Properties

Compound Name3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine
PubChem CID827711
Molecular FormulaC22H23N3
Molecular Weight329.45 g/mol
Exact Mass329.19
IUPAC Name3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine
SMILESCc1cccc(N2CCN(c3cccc(C)c3)C2c2cccnc2)c1
InChIInChI=1S/C22H23N3/c1-17-6-3-9-20(14-17)24-12-13-25(21-10-4-7-18(2)15-21)22(24)19-8-5-11-23-16-19/h3-11,14-16,22H,12-13H2,1-2H3
InChIKeyFVAZFFGPGLNAPD-UHFFFAOYSA-N
XLogP4.72
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine?
The IUPAC name of 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine (CID 827711) is 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine.
What is the SMILES notation for 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine?
The canonical SMILES for 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine is Cc1cccc(N2CCN(c3cccc(C)c3)C2c2cccnc2)c1.
What is the InChIKey of 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine?
The InChIKey is FVAZFFGPGLNAPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3/c1-17-6-3-9-20(14-17)24-12-13-25(21-10-4-7-18(2)15-21)22(24)19-8-5-11-23-16-19/h3-11,14-16,22H,12-13H2,1-2H3.
What are the key properties of 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine?
3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine has a molecular weight of 329.45 g/mol, XLogP of 4.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1,3-bis(3-methylphenyl)imidazolidin-2-yl]pyridine is sourced from PubChem (CID 827711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).