2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride

C14H17ClN2 — CID 6603471

IUPAC2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride
SMILESCc1ccc(-c2cn3c(n2)CCCC3)cc1.Cl
InChIInChI=1S/C14H16N2.ClH/c1-11-5-7-12(8-6-11)13-10-16-9-3-2-4-14(16)15-13;/h5-8,10H,2-4,9H2,1H3;1H
InChIKeyBCJBFAHAMCWLQO-UHFFFAOYSA-N
MW248.76 g/mol
LogP3.62
Rot. Bonds1

About 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride

2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride (PubChem CID 6603471) has the molecular formula C14H17ClN2 and a molecular weight of 248.76 g/mol. Its IUPAC name is 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride.

Molecular Properties

Compound Name2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride
PubChem CID6603471
Molecular FormulaC14H17ClN2
Molecular Weight248.76 g/mol
Exact Mass248.11
IUPAC Name2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride
SMILESCc1ccc(-c2cn3c(n2)CCCC3)cc1.Cl
InChIInChI=1S/C14H16N2.ClH/c1-11-5-7-12(8-6-11)13-10-16-9-3-2-4-14(16)15-13;/h5-8,10H,2-4,9H2,1H3;1H
InChIKeyBCJBFAHAMCWLQO-UHFFFAOYSA-N
XLogP3.62
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.76
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride?
The IUPAC name of 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride (CID 6603471) is 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride.
What is the SMILES notation for 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride?
The canonical SMILES for 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride is Cc1ccc(-c2cn3c(n2)CCCC3)cc1.Cl.
What is the InChIKey of 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride?
The InChIKey is BCJBFAHAMCWLQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2.ClH/c1-11-5-7-12(8-6-11)13-10-16-9-3-2-4-14(16)15-13;/h5-8,10H,2-4,9H2,1H3;1H.
What are the key properties of 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride?
2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride has a molecular weight of 248.76 g/mol, XLogP of 3.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;hydrochloride is sourced from PubChem (CID 6603471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).