1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C14H22N4 — CID 64857500

IUPAC1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCc1nc2c(n1C1CN3CCC1CC3)CCNC2
InChIInChI=1S/C14H22N4/c1-10-16-12-8-15-5-2-13(12)18(10)14-9-17-6-3-11(14)4-7-17/h11,14-15H,2-9H2,1H3
InChIKeyKOCFYOODEWBUOK-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.10
Rot. Bonds1

About 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64857500) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64857500
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCc1nc2c(n1C1CN3CCC1CC3)CCNC2
InChIInChI=1S/C14H22N4/c1-10-16-12-8-15-5-2-13(12)18(10)14-9-17-6-3-11(14)4-7-17/h11,14-15H,2-9H2,1H3
InChIKeyKOCFYOODEWBUOK-UHFFFAOYSA-N
XLogP1.10
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine with MolForge

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Related Compounds

2-methyl-1-(2-methylcyclopropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858126
2-methyl-1-(2,2,3,3-tetramethylcyclopropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 79350625
2-methyl-1-(4-methylcyclohexyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857125
4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)cyclohexan-1-ol
CID 64856730
1-(2,2-dimethylcyclopropyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857373
2-methyl-1-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857796
1,2-dimethyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 13150258
3-cyclopropyl-2-methyl-5,6,7,8-tetrahydro-4H-imidazo[4,5-d]azepine
CID 83864770
ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate
CID 64857902
1-(3,4-dihydro-2H-chromen-4-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857739
1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856548
2-cyclopropyl-1-(1-methylpiperidin-4-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858498

Frequently Asked Questions

What is the IUPAC name of 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64857500) is 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is Cc1nc2c(n1C1CN3CCC1CC3)CCNC2.
What is the InChIKey of 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is KOCFYOODEWBUOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-10-16-12-8-15-5-2-13(12)18(10)14-9-17-6-3-11(14)4-7-17/h11,14-15H,2-9H2,1H3.
What are the key properties of 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 246.36 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-azabicyclo[2.2.2]octan-3-yl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64857500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).