4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide

C19H25N5O — CID 146040392

IUPAC4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide
SMILESNC(=O)C1(N2CCCCC2)CCN(c2cnc3ccccc3n2)CC1
InChIInChI=1S/C19H25N5O/c20-18(25)19(24-10-4-1-5-11-24)8-12-23(13-9-19)17-14-21-15-6-2-3-7-16(15)22-17/h2-3,6-7,14H,1,4-5,8-13H2,(H2,20,25)
InChIKeyLVFQTEVNMUJOAJ-UHFFFAOYSA-N
MW339.44 g/mol
LogP1.94
Rot. Bonds3

About 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide

4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide (PubChem CID 146040392) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide
PubChem CID146040392
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide
SMILESNC(=O)C1(N2CCCCC2)CCN(c2cnc3ccccc3n2)CC1
InChIInChI=1S/C19H25N5O/c20-18(25)19(24-10-4-1-5-11-24)8-12-23(13-9-19)17-14-21-15-6-2-3-7-16(15)22-17/h2-3,6-7,14H,1,4-5,8-13H2,(H2,20,25)
InChIKeyLVFQTEVNMUJOAJ-UHFFFAOYSA-N
XLogP1.94
TPSA75.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide?
The IUPAC name of 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide (CID 146040392) is 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide is NC(=O)C1(N2CCCCC2)CCN(c2cnc3ccccc3n2)CC1.
What is the InChIKey of 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide?
The InChIKey is LVFQTEVNMUJOAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c20-18(25)19(24-10-4-1-5-11-24)8-12-23(13-9-19)17-14-21-15-6-2-3-7-16(15)22-17/h2-3,6-7,14H,1,4-5,8-13H2,(H2,20,25).
What are the key properties of 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide?
4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-1-yl-1-quinoxalin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 146040392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).