ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate

C15H24N4O2 — CID 64857902

IUPACethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(n2c(C)nc3c2CCNC3)CC1
InChIInChI=1S/C15H24N4O2/c1-3-21-15(20)18-8-5-12(6-9-18)19-11(2)17-13-10-16-7-4-14(13)19/h12,16H,3-10H2,1-2H3
InChIKeyOZYRXQLWBCMOQV-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.63
Rot. Bonds2

About ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate

ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate (PubChem CID 64857902) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate
PubChem CID64857902
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Nameethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(n2c(C)nc3c2CCNC3)CC1
InChIInChI=1S/C15H24N4O2/c1-3-21-15(20)18-8-5-12(6-9-18)19-11(2)17-13-10-16-7-4-14(13)19/h12,16H,3-10H2,1-2H3
InChIKeyOZYRXQLWBCMOQV-UHFFFAOYSA-N
XLogP1.63
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate with MolForge

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Related Compounds

ethyl 2-methyl-1-(1-prop-1-en-2-yloxycarbonylpiperidin-4-yl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxylate
CID 89161903
4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)cyclohexan-1-ol
CID 64856730
2-methyl-1-(4-methylcyclohexyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857125
3-cyclopropyl-2-methyl-5,6,7,8-tetrahydro-4H-imidazo[4,5-d]azepine
CID 83864770
2-methyl-1-(2-methylcyclopropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858126
1-(2,2-dimethylcyclopropyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857373
2-cyclopropyl-1-(1-methylpiperidin-4-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858498
ethyl 4-(2-pyridin-2-ylimidazo[4,5-b]pyridin-3-yl)piperidine-1-carboxylate
CID 21050439
2-ethyl-1-(4-methylcyclohexyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856928
1-[(1S,5R)-3-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-3-yl)-8-azabicyclo[3.2.1]octan-8-yl]ethanone
CID 68878460
ethane;ethyl pyrrolidine-1-carboxylate;piperidin-4-one
CID 143592038
1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856548

Frequently Asked Questions

What is the IUPAC name of ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate?
The IUPAC name of ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate (CID 64857902) is ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate?
The canonical SMILES for ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate is CCOC(=O)N1CCC(n2c(C)nc3c2CCNC3)CC1.
What is the InChIKey of ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate?
The InChIKey is OZYRXQLWBCMOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-3-21-15(20)18-8-5-12(6-9-18)19-11(2)17-13-10-16-7-4-14(13)19/h12,16H,3-10H2,1-2H3.
What are the key properties of ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate?
ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate has a molecular weight of 292.38 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-(2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)piperidine-1-carboxylate is sourced from PubChem (CID 64857902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).