2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine

C18H20N4 — CID 1090326

IUPAC2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
SMILESc1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)cc1
InChIInChI=1S/C18H20N4/c1-2-6-17(7-3-1)21-12-10-20(11-13-21)14-16-15-22-9-5-4-8-18(22)19-16/h1-9,15H,10-14H2
InChIKeyFRVVXCSEQZXJEC-UHFFFAOYSA-N
MW292.39 g/mol
LogP2.66
Rot. Bonds3

About 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine

2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine (PubChem CID 1090326) has the molecular formula C18H20N4 and a molecular weight of 292.39 g/mol. Its IUPAC name is 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
PubChem CID1090326
Molecular FormulaC18H20N4
Molecular Weight292.39 g/mol
Exact Mass292.17
IUPAC Name2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
SMILESc1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)cc1
InChIInChI=1S/C18H20N4/c1-2-6-17(7-3-1)21-12-10-20(11-13-21)14-16-15-22-9-5-4-8-18(22)19-16/h1-9,15H,10-14H2
InChIKeyFRVVXCSEQZXJEC-UHFFFAOYSA-N
XLogP2.66
TPSA23.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine (CID 1090326) is 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine is c1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)cc1.
What is the InChIKey of 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The InChIKey is FRVVXCSEQZXJEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4/c1-2-6-17(7-3-1)21-12-10-20(11-13-21)14-16-15-22-9-5-4-8-18(22)19-16/h1-9,15H,10-14H2.
What are the key properties of 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine has a molecular weight of 292.39 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 1090326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).