(4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C13H15N3 — CID 95989754

IUPAC(4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESC[C@]1(c2ccccc2)NCCc2[nH]cnc21
InChIInChI=1S/C13H15N3/c1-13(10-5-3-2-4-6-10)12-11(7-8-16-13)14-9-15-12/h2-6,9,16H,7-8H2,1H3,(H,14,15)/t13-/m1/s1
InChIKeyMTHIAFNXJHNUGN-CYBMUJFWSA-N
MW213.28 g/mol
LogP1.82
Rot. Bonds1

About (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine

(4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 95989754) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name(4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID95989754
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name(4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESC[C@]1(c2ccccc2)NCCc2[nH]cnc21
InChIInChI=1S/C13H15N3/c1-13(10-5-3-2-4-6-10)12-11(7-8-16-13)14-9-15-12/h2-6,9,16H,7-8H2,1H3,(H,14,15)/t13-/m1/s1
InChIKeyMTHIAFNXJHNUGN-CYBMUJFWSA-N
XLogP1.82
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 95989754) is (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine is C[C@]1(c2ccccc2)NCCc2[nH]cnc21.
What is the InChIKey of (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is MTHIAFNXJHNUGN-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H15N3/c1-13(10-5-3-2-4-6-10)12-11(7-8-16-13)14-9-15-12/h2-6,9,16H,7-8H2,1H3,(H,14,15)/t13-/m1/s1.
What are the key properties of (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
(4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 213.28 g/mol, XLogP of 1.82, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methyl-4-phenyl-1,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 95989754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).