[2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol

C15H17ClN2O — CID 117153628

IUPAC[2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol
SMILESOCC1CCc2nc(Cc3ccc(Cl)cc3)cn2C1
InChIInChI=1S/C15H17ClN2O/c16-13-4-1-11(2-5-13)7-14-9-18-8-12(10-19)3-6-15(18)17-14/h1-2,4-5,9,12,19H,3,6-8,10H2
InChIKeyMLAOTDATJUTLEQ-UHFFFAOYSA-N
MW276.77 g/mol
LogP2.68
Rot. Bonds3

About [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol

[2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol (PubChem CID 117153628) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol.

Molecular Properties

Compound Name[2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol
PubChem CID117153628
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name[2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol
SMILESOCC1CCc2nc(Cc3ccc(Cl)cc3)cn2C1
InChIInChI=1S/C15H17ClN2O/c16-13-4-1-11(2-5-13)7-14-9-18-8-12(10-19)3-6-15(18)17-14/h1-2,4-5,9,12,19H,3,6-8,10H2
InChIKeyMLAOTDATJUTLEQ-UHFFFAOYSA-N
XLogP2.68
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol?
The IUPAC name of [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol (CID 117153628) is [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol.
What is the SMILES notation for [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol?
The canonical SMILES for [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol is OCC1CCc2nc(Cc3ccc(Cl)cc3)cn2C1.
What is the InChIKey of [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol?
The InChIKey is MLAOTDATJUTLEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O/c16-13-4-1-11(2-5-13)7-14-9-18-8-12(10-19)3-6-15(18)17-14/h1-2,4-5,9,12,19H,3,6-8,10H2.
What are the key properties of [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol?
[2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol has a molecular weight of 276.77 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-chlorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methanol is sourced from PubChem (CID 117153628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).