5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine

C13H18N4O — CID 65484424

IUPAC5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccc2[nH]c(C3(C)CCCNC3)nc2n1
InChIInChI=1S/C13H18N4O/c1-13(6-3-7-14-8-13)12-15-9-4-5-10(18-2)16-11(9)17-12/h4-5,14H,3,6-8H2,1-2H3,(H,15,16,17)
InChIKeyBQHCWICAUGOHNT-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.61
Rot. Bonds2

About 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine

5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine (PubChem CID 65484424) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine
PubChem CID65484424
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1ccc2[nH]c(C3(C)CCCNC3)nc2n1
InChIInChI=1S/C13H18N4O/c1-13(6-3-7-14-8-13)12-15-9-4-5-10(18-2)16-11(9)17-12/h4-5,14H,3,6-8H2,1-2H3,(H,15,16,17)
InChIKeyBQHCWICAUGOHNT-UHFFFAOYSA-N
XLogP1.61
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methoxy-2-piperidin-3-yl-1H-imidazo[4,5-b]pyridine
CID 65483260
5-methoxy-2-[(1-methoxycyclobutyl)methyl]-1H-imidazo[4,5-b]pyridine
CID 103557135
2-(3-propylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 79820861
5-methoxy-2-(piperidin-4-ylmethyl)-1H-imidazo[4,5-b]pyridine
CID 79615004
2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-methylcyclopentan-1-amine
CID 82762846
5-methoxy-2-(piperazin-1-ylmethyl)-1H-imidazo[4,5-b]pyridine
CID 65483646
5-methoxy-2-(piperidin-4-yloxymethyl)-1H-imidazo[4,5-b]pyridine
CID 65484225
4-methoxy-2-(3-methylpiperidin-3-yl)-1,3-benzoxazole
CID 114765029
5,6-difluoro-2-(3-methylpyrrolidin-3-yl)-1H-benzimidazole
CID 63144065
5,6-dichloro-2-(1-methylcyclopentyl)-1H-imidazo[4,5-b]pyridine
CID 113360917
5-methyl-2-[3-(trifluoromethyl)pyrrolidin-3-yl]-1H-imidazo[4,5-b]pyridine
CID 81136885
2-(5-methoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylpropan-2-amine
CID 65484228

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine (CID 65484424) is 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine is COc1ccc2[nH]c(C3(C)CCCNC3)nc2n1.
What is the InChIKey of 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is BQHCWICAUGOHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-13(6-3-7-14-8-13)12-15-9-4-5-10(18-2)16-11(9)17-12/h4-5,14H,3,6-8H2,1-2H3,(H,15,16,17).
What are the key properties of 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine?
5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 246.31 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-(3-methylpiperidin-3-yl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 65484424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).