3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

C15H17ClN2 — CID 114081635

IUPAC3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESCc1nc2n(c1-c1ccc(Cl)cc1)CCCC2C
InChIInChI=1S/C15H17ClN2/c1-10-4-3-9-18-14(11(2)17-15(10)18)12-5-7-13(16)8-6-12/h5-8,10H,3-4,9H2,1-2H3
InChIKeyCJFBTYGUXDCBCP-UHFFFAOYSA-N
MW260.77 g/mol
LogP4.41
Rot. Bonds1

About 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine

3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (PubChem CID 114081635) has the molecular formula C15H17ClN2 and a molecular weight of 260.77 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
PubChem CID114081635
Molecular FormulaC15H17ClN2
Molecular Weight260.77 g/mol
Exact Mass260.11
IUPAC Name3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine
SMILESCc1nc2n(c1-c1ccc(Cl)cc1)CCCC2C
InChIInChI=1S/C15H17ClN2/c1-10-4-3-9-18-14(11(2)17-15(10)18)12-5-7-13(16)8-6-12/h5-8,10H,3-4,9H2,1-2H3
InChIKeyCJFBTYGUXDCBCP-UHFFFAOYSA-N
XLogP4.41
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.77
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The IUPAC name of 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine (CID 114081635) is 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The canonical SMILES for 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is Cc1nc2n(c1-c1ccc(Cl)cc1)CCCC2C.
What is the InChIKey of 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
The InChIKey is CJFBTYGUXDCBCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2/c1-10-4-3-9-18-14(11(2)17-15(10)18)12-5-7-13(16)8-6-12/h5-8,10H,3-4,9H2,1-2H3.
What are the key properties of 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine?
3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine has a molecular weight of 260.77 g/mol, XLogP of 4.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-2,8-dimethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 114081635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).