1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol

C17H18ClN3O — CID 111467156

IUPAC1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol
SMILESCc1ccn2c(CNCC(O)c3ccccc3Cl)cnc2c1
InChIInChI=1S/C17H18ClN3O/c1-12-6-7-21-13(10-20-17(21)8-12)9-19-11-16(22)14-4-2-3-5-15(14)18/h2-8,10,16,19,22H,9,11H2,1H3
InChIKeyJMQRJYXSBNBGGM-UHFFFAOYSA-N
MW315.80 g/mol
LogP3.12
Rot. Bonds5

About 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol

1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol (PubChem CID 111467156) has the molecular formula C17H18ClN3O and a molecular weight of 315.80 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol
PubChem CID111467156
Molecular FormulaC17H18ClN3O
Molecular Weight315.80 g/mol
Exact Mass315.11
IUPAC Name1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol
SMILESCc1ccn2c(CNCC(O)c3ccccc3Cl)cnc2c1
InChIInChI=1S/C17H18ClN3O/c1-12-6-7-21-13(10-20-17(21)8-12)9-19-11-16(22)14-4-2-3-5-15(14)18/h2-8,10,16,19,22H,9,11H2,1H3
InChIKeyJMQRJYXSBNBGGM-UHFFFAOYSA-N
XLogP3.12
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.80
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol?
The IUPAC name of 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol (CID 111467156) is 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol.
What is the SMILES notation for 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol?
The canonical SMILES for 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol is Cc1ccn2c(CNCC(O)c3ccccc3Cl)cnc2c1.
What is the InChIKey of 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol?
The InChIKey is JMQRJYXSBNBGGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O/c1-12-6-7-21-13(10-20-17(21)8-12)9-19-11-16(22)14-4-2-3-5-15(14)18/h2-8,10,16,19,22H,9,11H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol?
1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol has a molecular weight of 315.80 g/mol, XLogP of 3.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-2-[(7-methylimidazo[1,2-a]pyridin-3-yl)methylamino]ethanol is sourced from PubChem (CID 111467156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).