(3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone

C22H22N4O — CID 10522389

IUPAC(3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone
SMILESO=C(N1CCCCC1)N1Cc2c(-c3ccccc3)ncn2-c2ccccc21
InChIInChI=1S/C22H22N4O/c27-22(24-13-7-2-8-14-24)25-15-20-21(17-9-3-1-4-10-17)23-16-26(20)19-12-6-5-11-18(19)25/h1,3-6,9-12,16H,2,7-8,13-15H2
InChIKeyPJEFLMXDKFQQMT-UHFFFAOYSA-N
MW358.44 g/mol
LogP4.47
Rot. Bonds1

About (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone

(3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone (PubChem CID 10522389) has the molecular formula C22H22N4O and a molecular weight of 358.44 g/mol. Its IUPAC name is (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone
PubChem CID10522389
Molecular FormulaC22H22N4O
Molecular Weight358.44 g/mol
Exact Mass358.18
IUPAC Name(3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone
SMILESO=C(N1CCCCC1)N1Cc2c(-c3ccccc3)ncn2-c2ccccc21
InChIInChI=1S/C22H22N4O/c27-22(24-13-7-2-8-14-24)25-15-20-21(17-9-3-1-4-10-17)23-16-26(20)19-12-6-5-11-18(19)25/h1,3-6,9-12,16H,2,7-8,13-15H2
InChIKeyPJEFLMXDKFQQMT-UHFFFAOYSA-N
XLogP4.47
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone?
The IUPAC name of (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone (CID 10522389) is (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone is O=C(N1CCCCC1)N1Cc2c(-c3ccccc3)ncn2-c2ccccc21.
What is the InChIKey of (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone?
The InChIKey is PJEFLMXDKFQQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O/c27-22(24-13-7-2-8-14-24)25-15-20-21(17-9-3-1-4-10-17)23-16-26(20)19-12-6-5-11-18(19)25/h1,3-6,9-12,16H,2,7-8,13-15H2.
What are the key properties of (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone?
(3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone has a molecular weight of 358.44 g/mol, XLogP of 4.47, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-phenyl-4H-imidazo[1,5-a]quinoxalin-5-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 10522389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).