6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine

C12H16N4 — CID 167170087

IUPAC6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine
SMILESCc1cc2nc(C3CCCN3C)[nH]c2cn1
InChIInChI=1S/C12H16N4/c1-8-6-9-10(7-13-8)15-12(14-9)11-4-3-5-16(11)2/h6-7,11H,3-5H2,1-2H3,(H,14,15)
InChIKeyNBCTUOBTYWIDIG-UHFFFAOYSA-N
MW216.29 g/mol
LogP2.03
Rot. Bonds1

About 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine

6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine (PubChem CID 167170087) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine
PubChem CID167170087
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine
SMILESCc1cc2nc(C3CCCN3C)[nH]c2cn1
InChIInChI=1S/C12H16N4/c1-8-6-9-10(7-13-8)15-12(14-9)11-4-3-5-16(11)2/h6-7,11H,3-5H2,1-2H3,(H,14,15)
InChIKeyNBCTUOBTYWIDIG-UHFFFAOYSA-N
XLogP2.03
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-2-(1-methylpyrrolidin-2-yl)-1H-benzimidazole
CID 170441623
2-[(2S)-1-methylpyrrolidin-2-yl]-1H-benzimidazole;3-(1-methylpyrrolidin-2-yl)-1H-indole
CID 144805141
2-methyl-5-(1-methylpyrrolidin-2-yl)pyridine
CID 5020711
9,9-difluoro-7-[2-(1-methylpyrrolidin-2-yl)-3H-benzimidazol-5-yl]fluoren-2-amine
CID 145305491
[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-(6-methyl-3-pyridinyl)methanone
CID 51331975
4,6-dimethyl-2-[(2S)-1-methylpiperidin-2-yl]pyrimidine
CID 95817120
4-(4-bromophenyl)-5-methyl-2-(1-methylpyrrolidin-2-yl)-1H-imidazole
CID 129212326
2-[(2R)-1-(5-fluoropyrimidin-2-yl)pyrrolidin-2-yl]-6-methyl-1H-benzimidazole
CID 125419133
tert-butyl 2-[6-[1-hydroxy-5-[2-(1-methylpyrrolidin-2-yl)-3H-benzimidazol-5-yl]pyrrolidin-2-yl]-1H-benzimidazol-2-yl]pyrrolidine-1-carboxylate
CID 123221925
1-[5-(1-methylpyrrolidin-2-yl)-1H-imidazol-2-yl]ethanamine
CID 115019985
4-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-2-amine
CID 59551929
5-[2-[(2S)-1-methylpyrrolidin-2-yl]-1H-imidazol-5-yl]-2-[4-[2-[(2S)-1-methylpyrrolidin-2-yl]-1H-imidazol-5-yl]phenyl]pyrimidine
CID 143630216

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine?
The IUPAC name of 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine (CID 167170087) is 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine?
The canonical SMILES for 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine is Cc1cc2nc(C3CCCN3C)[nH]c2cn1.
What is the InChIKey of 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine?
The InChIKey is NBCTUOBTYWIDIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-8-6-9-10(7-13-8)15-12(14-9)11-4-3-5-16(11)2/h6-7,11H,3-5H2,1-2H3,(H,14,15).
What are the key properties of 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine?
6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine has a molecular weight of 216.29 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(1-methylpyrrolidin-2-yl)-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 167170087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).