(2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine

C17H21N3 — CID 118084606

IUPAC(2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine
SMILESCc1ccccc1N1c2ncccc2N(C(C)C)[C@H]1C
InChIInChI=1S/C17H21N3/c1-12(2)19-14(4)20(15-9-6-5-8-13(15)3)17-16(19)10-7-11-18-17/h5-12,14H,1-4H3/t14-/m1/s1
InChIKeyCHIGQMLFZZQZOL-CQSZACIVSA-N
MW267.38 g/mol
LogP4.10
Rot. Bonds2

About (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine

(2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine (PubChem CID 118084606) has the molecular formula C17H21N3 and a molecular weight of 267.38 g/mol. Its IUPAC name is (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name(2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine
PubChem CID118084606
Molecular FormulaC17H21N3
Molecular Weight267.38 g/mol
Exact Mass267.17
IUPAC Name(2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine
SMILESCc1ccccc1N1c2ncccc2N(C(C)C)[C@H]1C
InChIInChI=1S/C17H21N3/c1-12(2)19-14(4)20(15-9-6-5-8-13(15)3)17-16(19)10-7-11-18-17/h5-12,14H,1-4H3/t14-/m1/s1
InChIKeyCHIGQMLFZZQZOL-CQSZACIVSA-N
XLogP4.10
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine?
The IUPAC name of (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine (CID 118084606) is (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine.
What is the SMILES notation for (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine?
The canonical SMILES for (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine is Cc1ccccc1N1c2ncccc2N(C(C)C)[C@H]1C.
What is the InChIKey of (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine?
The InChIKey is CHIGQMLFZZQZOL-CQSZACIVSA-N. The full InChI is InChI=1S/C17H21N3/c1-12(2)19-14(4)20(15-9-6-5-8-13(15)3)17-16(19)10-7-11-18-17/h5-12,14H,1-4H3/t14-/m1/s1.
What are the key properties of (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine?
(2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine has a molecular weight of 267.38 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-3-(2-methylphenyl)-1-propan-2-yl-2H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 118084606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).