1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride

C7H11ClN2 — CID 139606758

IUPAC1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride
SMILESC1=CCN2CNCC2=C1.Cl
InChIInChI=1S/C7H10N2.ClH/c1-2-4-9-6-8-5-7(9)3-1;/h1-3,8H,4-6H2;1H
InChIKeyNNJVWYHSWPQCKP-UHFFFAOYSA-N
MW158.63 g/mol
LogP0.72
Rot. Bonds

About 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride

1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride (PubChem CID 139606758) has the molecular formula C7H11ClN2 and a molecular weight of 158.63 g/mol. Its IUPAC name is 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride.

Molecular Properties

Compound Name1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride
PubChem CID139606758
Molecular FormulaC7H11ClN2
Molecular Weight158.63 g/mol
Exact Mass158.06
IUPAC Name1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride
SMILESC1=CCN2CNCC2=C1.Cl
InChIInChI=1S/C7H10N2.ClH/c1-2-4-9-6-8-5-7(9)3-1;/h1-3,8H,4-6H2;1H
InChIKeyNNJVWYHSWPQCKP-UHFFFAOYSA-N
XLogP0.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.63
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 134613103
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CID 139030560
CID 139030560
CID 139030563
CID 139030563
CID 139030576
CID 139030576
CID 21683303
CID 21683303
CID 66973714
CID 66973714
CID 68089779
CID 68089779
CID 68440928
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CID 68704974

Frequently Asked Questions

What is the IUPAC name of 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride?
The IUPAC name of 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride (CID 139606758) is 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride.
What is the SMILES notation for 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride?
The canonical SMILES for 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride is C1=CCN2CNCC2=C1.Cl.
What is the InChIKey of 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride?
The InChIKey is NNJVWYHSWPQCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2.ClH/c1-2-4-9-6-8-5-7(9)3-1;/h1-3,8H,4-6H2;1H.
What are the key properties of 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride?
1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride has a molecular weight of 158.63 g/mol, XLogP of 0.72, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,5-tetrahydroimidazo[1,5-a]pyridine;hydrochloride is sourced from PubChem (CID 139606758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).