N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide

C21H26N4O2 — CID 47031610

IUPACN-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide
SMILESO=C(NC1CCN(C(=O)C2CCCCC2)CC1)c1cnc2ccccc2n1
InChIInChI=1S/C21H26N4O2/c26-20(19-14-22-17-8-4-5-9-18(17)24-19)23-16-10-12-25(13-11-16)21(27)15-6-2-1-3-7-15/h4-5,8-9,14-16H,1-3,6-7,10-13H2,(H,23,26)
InChIKeyOWAZGNLBMQYBLF-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.93
Rot. Bonds3

About N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide

N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide (PubChem CID 47031610) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide.

Molecular Properties

Compound NameN-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide
PubChem CID47031610
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC NameN-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide
SMILESO=C(NC1CCN(C(=O)C2CCCCC2)CC1)c1cnc2ccccc2n1
InChIInChI=1S/C21H26N4O2/c26-20(19-14-22-17-8-4-5-9-18(17)24-19)23-16-10-12-25(13-11-16)21(27)15-6-2-1-3-7-15/h4-5,8-9,14-16H,1-3,6-7,10-13H2,(H,23,26)
InChIKeyOWAZGNLBMQYBLF-UHFFFAOYSA-N
XLogP2.93
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclooctylquinoxaline-2-carboxamide
CID 22136387
2-N-[1-(cyclopentanecarbonyl)piperidin-4-yl]pyrazine-2,5-dicarboxamide
CID 137336941
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]quinoxaline-2-carboxamide
CID 46589381
N-cyclohexyl-4-(quinoxaline-2-carbonyl)piperazine-1-carboxamide
CID 55595762
N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)quinoxaline-2-carboxamide
CID 45352272
N-[(3R)-piperidin-3-yl]quinoxaline-2-carboxamide
CID 105061101
N-pyrrolidin-3-ylquinoxaline-2-carboxamide
CID 113265403
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-3-hydroxynaphthalene-2-carboxamide
CID 55690810
N-[1-(cyclododecylamino)-3-hydroxy-1-oxopropan-2-yl]quinoxaline-2-carboxamide
CID 4051543
N-[1-(cyclobutanecarbonyl)piperidin-4-yl]-4-phenylbenzamide
CID 52898200
[4-(methylamino)piperidin-1-yl]-quinoxalin-2-ylmethanone;dihydrochloride
CID 119559840
2-chloro-N-[1-(cyclobutanecarbonyl)piperidin-4-yl]benzamide
CID 110822148

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide?
The IUPAC name of N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide (CID 47031610) is N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide.
What is the SMILES notation for N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide?
The canonical SMILES for N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide is O=C(NC1CCN(C(=O)C2CCCCC2)CC1)c1cnc2ccccc2n1.
What is the InChIKey of N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide?
The InChIKey is OWAZGNLBMQYBLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c26-20(19-14-22-17-8-4-5-9-18(17)24-19)23-16-10-12-25(13-11-16)21(27)15-6-2-1-3-7-15/h4-5,8-9,14-16H,1-3,6-7,10-13H2,(H,23,26).
What are the key properties of N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide?
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclohexanecarbonyl)piperidin-4-yl]quinoxaline-2-carboxamide is sourced from PubChem (CID 47031610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).