1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine

C11H15N3 — CID 59097694

IUPAC1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine
SMILESCc1nc2nc(C(C)C)ccc2n1C
InChIInChI=1S/C11H15N3/c1-7(2)9-5-6-10-11(13-9)12-8(3)14(10)4/h5-7H,1-4H3
InChIKeySMLLDOHAIMHUSN-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.40
Rot. Bonds1

About 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine

1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine (PubChem CID 59097694) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine
PubChem CID59097694
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine
SMILESCc1nc2nc(C(C)C)ccc2n1C
InChIInChI=1S/C11H15N3/c1-7(2)9-5-6-10-11(13-9)12-8(3)14(10)4/h5-7H,1-4H3
InChIKeySMLLDOHAIMHUSN-UHFFFAOYSA-N
XLogP2.40
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

8-methyl-4,12-di(propan-2-yl)-3,8,13-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 67988424
2-methyl-3,6-di(propan-2-yl)pyridine
CID 20738069
6-methyl-2-propan-2-yl-1,8-naphthyridine
CID 56624410
1-methyl-2-(2-methylpropyl)-5-propan-2-ylpyrrolo[3,2-b]pyridine
CID 58499140
2-methyl-3,5-di(propan-2-yl)imidazo[4,5-b]pyridine
CID 171551848
2-ethyl-7,8-dimethylpurine
CID 10487505
1-(1,2-dimethylbenzimidazol-5-yl)-2-methylpropan-1-amine
CID 82493454
2-methoxy-4-(2-methyl-4-propan-2-ylimidazol-1-yl)pyridine
CID 146385853
2,3-dimethylimidazo[4,5-b]pyrazine
CID 59974515
1,3,5-tri(propan-2-yl)pyrazolo[4,3-b]pyridine
CID 170938130
1,3-dimethyl-7-propan-2-ylpyrido[2,3-d]pyrimidine-2,4-dione
CID 51109198
6-chloro-1,2-dimethyl-5-propan-2-ylbenzimidazole
CID 21329570

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine?
The IUPAC name of 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine (CID 59097694) is 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine is Cc1nc2nc(C(C)C)ccc2n1C.
What is the InChIKey of 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine?
The InChIKey is SMLLDOHAIMHUSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-7(2)9-5-6-10-11(13-9)12-8(3)14(10)4/h5-7H,1-4H3.
What are the key properties of 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine?
1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine has a molecular weight of 189.26 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-5-propan-2-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 59097694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).