N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide

C20H21N5O2 — CID 156673154

IUPACN-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide
SMILESNc1cc(OC2CCC(NC(=O)c3cccnc3)CC2)c2nccnc2c1
InChIInChI=1S/C20H21N5O2/c21-14-10-17-19(24-9-8-23-17)18(11-14)27-16-5-3-15(4-6-16)25-20(26)13-2-1-7-22-12-13/h1-2,7-12,15-16H,3-6,21H2,(H,25,26)
InChIKeyKPMPEOAMCWUMHH-UHFFFAOYSA-N
MW363.42 g/mol
LogP2.73
Rot. Bonds4

About N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide

N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide (PubChem CID 156673154) has the molecular formula C20H21N5O2 and a molecular weight of 363.42 g/mol. Its IUPAC name is N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide
PubChem CID156673154
Molecular FormulaC20H21N5O2
Molecular Weight363.42 g/mol
Exact Mass363.17
IUPAC NameN-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide
SMILESNc1cc(OC2CCC(NC(=O)c3cccnc3)CC2)c2nccnc2c1
InChIInChI=1S/C20H21N5O2/c21-14-10-17-19(24-9-8-23-17)18(11-14)27-16-5-3-15(4-6-16)25-20(26)13-2-1-7-22-12-13/h1-2,7-12,15-16H,3-6,21H2,(H,25,26)
InChIKeyKPMPEOAMCWUMHH-UHFFFAOYSA-N
XLogP2.73
TPSA103.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

6-[[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]amino]-N-methylpyridine-3-carboxamide
CID 156630311
N-cyclopentylpyridine-3-carboxamide
CID 805532
N-[4-[(7-morpholin-4-yl-1,6-naphthyridin-5-yl)oxy]cyclohexyl]pyridine-3-carboxamide
CID 165112973
8-[4-[(5-propan-2-yloxypyrimidin-2-yl)amino]cyclohexyl]oxyquinoxalin-6-amine
CID 156673135
3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide
CID 86281846
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide
CID 86281578
N-(4-ethylcyclohexyl)pyridine-3-carboxamide
CID 25237064
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-2-carboxamide
CID 86281319
6-oxo-N-(4-quinolin-6-yloxycyclohexyl)pyran-3-carboxamide
CID 176505850
N-[4-[(3-aminophenyl)methylidene]cyclohexyl]pyridine-3-carboxamide
CID 89463574
N-cycloheptyl-4-[1-(pyridine-3-carbonyl)piperidin-4-yl]oxybenzamide
CID 126460807
6-[[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]amino]-N-methylpyridine-3-carboxamide;6-[[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]amino]-N-[(3S)-oxolan-3-yl]pyridine-3-carboxamide;2-N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]-5-N,5-N-diethylpyrimidine-2,5-diamine;8-[4-[[5-(azetidin-1-yl)pyrimidin-2-yl]amino]cyclohexyl]oxyquinoxalin-6-amine;ethoxyethane
CID 159088201

Frequently Asked Questions

What is the IUPAC name of N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide?
The IUPAC name of N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide (CID 156673154) is N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide?
The canonical SMILES for N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide is Nc1cc(OC2CCC(NC(=O)c3cccnc3)CC2)c2nccnc2c1.
What is the InChIKey of N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide?
The InChIKey is KPMPEOAMCWUMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O2/c21-14-10-17-19(24-9-8-23-17)18(11-14)27-16-5-3-15(4-6-16)25-20(26)13-2-1-7-22-12-13/h1-2,7-12,15-16H,3-6,21H2,(H,25,26).
What are the key properties of N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide?
N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide has a molecular weight of 363.42 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(7-aminoquinoxalin-5-yl)oxycyclohexyl]pyridine-3-carboxamide is sourced from PubChem (CID 156673154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).