[3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol

C9H13ClN2O — CID 116984469

IUPAC[3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
SMILESOCc1nc(CCl)n2c1CCCC2
InChIInChI=1S/C9H13ClN2O/c10-5-9-11-7(6-13)8-3-1-2-4-12(8)9/h13H,1-6H2
InChIKeyHJKZRDLHSOUKHJ-UHFFFAOYSA-N
MW200.67 g/mol
LogP1.45
Rot. Bonds2

About [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol

[3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol (PubChem CID 116984469) has the molecular formula C9H13ClN2O and a molecular weight of 200.67 g/mol. Its IUPAC name is [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol.

Molecular Properties

Compound Name[3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
PubChem CID116984469
Molecular FormulaC9H13ClN2O
Molecular Weight200.67 g/mol
Exact Mass200.07
IUPAC Name[3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
SMILESOCc1nc(CCl)n2c1CCCC2
InChIInChI=1S/C9H13ClN2O/c10-5-9-11-7(6-13)8-3-1-2-4-12(8)9/h13H,1-6H2
InChIKeyHJKZRDLHSOUKHJ-UHFFFAOYSA-N
XLogP1.45
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.67
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carbonitrile
CID 116984332
(3-hydrazinyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol
CID 116984559
[3-[1-(hydroxymethyl)cyclobutyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
CID 116984533
(3-piperazin-1-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)methanol
CID 116984493
2-[1-(hydroxymethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl]butan-1-ol
CID 116984543
(3-chloro-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methanol
CID 84660796
1-chloro-3-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine
CID 117248156
(1-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)methanethiol
CID 117247227
2-(3-propyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetonitrile
CID 116836798
[3-(3-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
CID 116836872
3-(chloromethyl)-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
CID 66489687
[3-(4-methylpiperazin-2-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol
CID 116984511

Frequently Asked Questions

What is the IUPAC name of [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol?
The IUPAC name of [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol (CID 116984469) is [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol.
What is the SMILES notation for [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol?
The canonical SMILES for [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol is OCc1nc(CCl)n2c1CCCC2.
What is the InChIKey of [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol?
The InChIKey is HJKZRDLHSOUKHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClN2O/c10-5-9-11-7(6-13)8-3-1-2-4-12(8)9/h13H,1-6H2.
What are the key properties of [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol?
[3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol has a molecular weight of 200.67 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(chloromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl]methanol is sourced from PubChem (CID 116984469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).