1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol

C12H13ClN2O2 — CID 117249760

IUPAC1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol
SMILESCc1ccc(-c2nc(Cl)c3n2CCCC3O)o1
InChIInChI=1S/C12H13ClN2O2/c1-7-4-5-9(17-7)12-14-11(13)10-8(16)3-2-6-15(10)12/h4-5,8,16H,2-3,6H2,1H3
InChIKeyQJKMLKPWZPLBFQ-UHFFFAOYSA-N
MW252.70 g/mol
LogP2.93
Rot. Bonds1

About 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol

1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol (PubChem CID 117249760) has the molecular formula C12H13ClN2O2 and a molecular weight of 252.70 g/mol. Its IUPAC name is 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol.

Molecular Properties

Compound Name1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol
PubChem CID117249760
Molecular FormulaC12H13ClN2O2
Molecular Weight252.70 g/mol
Exact Mass252.07
IUPAC Name1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol
SMILESCc1ccc(-c2nc(Cl)c3n2CCCC3O)o1
InChIInChI=1S/C12H13ClN2O2/c1-7-4-5-9(17-7)12-14-11(13)10-8(16)3-2-6-15(10)12/h4-5,8,16H,2-3,6H2,1H3
InChIKeyQJKMLKPWZPLBFQ-UHFFFAOYSA-N
XLogP2.93
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.70
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol with MolForge

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Related Compounds

1-chloro-8-methyl-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117249792
2-(5-methylfuran-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-ol
CID 117158060
1-chloro-3-(furan-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine
CID 117249754
methyl 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxylate
CID 117248379
1-chloro-3-pyrrolidin-3-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol
CID 117249610
8-hydroxy-3-(4-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 137005540
8-hydroxy-3-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 117249989
1-chloro-3-(2-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-amine
CID 117250047
(4-chlorophenyl)-[(3S)-3-[3-(5-methylfuran-2-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
CID 1457612
5-bromo-4,6-dichloro-2-(5-methylfuran-2-yl)pyrimidine
CID 66313382
8-hydroxy-3-(2-hydroxyphenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 137005526
methyl 3-(5-methylfuran-2-yl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine-7-carboxylate
CID 136557127

Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol?
The IUPAC name of 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol (CID 117249760) is 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol.
What is the SMILES notation for 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol?
The canonical SMILES for 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol is Cc1ccc(-c2nc(Cl)c3n2CCCC3O)o1.
What is the InChIKey of 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol?
The InChIKey is QJKMLKPWZPLBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13ClN2O2/c1-7-4-5-9(17-7)12-14-11(13)10-8(16)3-2-6-15(10)12/h4-5,8,16H,2-3,6H2,1H3.
What are the key properties of 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol?
1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol has a molecular weight of 252.70 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-ol is sourced from PubChem (CID 117249760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).