N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide

C23H30N4O2 — CID 108549986

IUPACN-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESCc1nc2ccc(C(=O)N3CCC(NC(=O)C4CCCCC4)CC3)cc2nc1C
InChIInChI=1S/C23H30N4O2/c1-15-16(2)25-21-14-18(8-9-20(21)24-15)23(29)27-12-10-19(11-13-27)26-22(28)17-6-4-3-5-7-17/h8-9,14,17,19H,3-7,10-13H2,1-2H3,(H,26,28)
InChIKeyXDROZOSXSFXIBR-UHFFFAOYSA-N
MW394.52 g/mol
LogP3.55
Rot. Bonds3

About N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide

N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide (PubChem CID 108549986) has the molecular formula C23H30N4O2 and a molecular weight of 394.52 g/mol. Its IUPAC name is N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide
PubChem CID108549986
Molecular FormulaC23H30N4O2
Molecular Weight394.52 g/mol
Exact Mass394.24
IUPAC NameN-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESCc1nc2ccc(C(=O)N3CCC(NC(=O)C4CCCCC4)CC3)cc2nc1C
InChIInChI=1S/C23H30N4O2/c1-15-16(2)25-21-14-18(8-9-20(21)24-15)23(29)27-12-10-19(11-13-27)26-22(28)17-6-4-3-5-7-17/h8-9,14,17,19H,3-7,10-13H2,1-2H3,(H,26,28)
InChIKeyXDROZOSXSFXIBR-UHFFFAOYSA-N
XLogP3.55
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108552552
azocan-1-yl-(2,3-dimethylquinoxalin-6-yl)methanone
CID 47009187
(2,3-dimethylquinoxalin-6-yl)-[4-(sulfanylamino)piperidin-1-yl]methanone
CID 163968262
N-[1-(3-methylbenzoyl)piperidin-4-yl]cyclopentanecarboxamide
CID 110820278
[4-(azepan-1-yl)piperidin-1-yl]-(2,3-dimethylquinoxalin-6-yl)methanone
CID 110667059
3-chloro-N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]propanamide
CID 108565725
N-[1-(4-methylbenzoyl)piperidin-4-yl]cyclobutanecarboxamide
CID 110820327
N-[1-(1,2-dimethylbenzimidazole-5-carbonyl)piperidin-4-yl]cyclopropanecarboxamide
CID 51101306
N-[1-(3H-benzimidazole-5-carbonyl)piperidin-4-yl]cyclopentanecarboxamide
CID 110821508
N-(1-benzoylpiperidin-4-yl)cyclopentanecarboxamide
CID 110820191
1-(2,3-dimethylquinoxaline-6-carbonyl)-N-(5-methyl-1,2-oxazol-3-yl)piperidine-4-carboxamide
CID 51299844
N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]-2,3-dimethylquinoxaline-6-carboxamide
CID 108554445

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide (CID 108549986) is N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide is Cc1nc2ccc(C(=O)N3CCC(NC(=O)C4CCCCC4)CC3)cc2nc1C.
What is the InChIKey of N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide?
The InChIKey is XDROZOSXSFXIBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O2/c1-15-16(2)25-21-14-18(8-9-20(21)24-15)23(29)27-12-10-19(11-13-27)26-22(28)17-6-4-3-5-7-17/h8-9,14,17,19H,3-7,10-13H2,1-2H3,(H,26,28).
What are the key properties of N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide?
N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide has a molecular weight of 394.52 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]cyclohexanecarboxamide is sourced from PubChem (CID 108549986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).