7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide

C21H15FN4O2 — CID 166179906

IUPAC7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide
SMILESO=C(Nc1ccnc(OCc2ccccc2)c1)c1cc(F)cc2nccnc12
InChIInChI=1S/C21H15FN4O2/c22-15-10-17(20-18(11-15)23-8-9-25-20)21(27)26-16-6-7-24-19(12-16)28-13-14-4-2-1-3-5-14/h1-12H,13H2,(H,24,26,27)
InChIKeyRGUVQDKSLSEZHQ-UHFFFAOYSA-N
MW374.38 g/mol
LogP4.00
Rot. Bonds5

About 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide

7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide (PubChem CID 166179906) has the molecular formula C21H15FN4O2 and a molecular weight of 374.38 g/mol. Its IUPAC name is 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide.

Molecular Properties

Compound Name7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide
PubChem CID166179906
Molecular FormulaC21H15FN4O2
Molecular Weight374.38 g/mol
Exact Mass374.12
IUPAC Name7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide
SMILESO=C(Nc1ccnc(OCc2ccccc2)c1)c1cc(F)cc2nccnc12
InChIInChI=1S/C21H15FN4O2/c22-15-10-17(20-18(11-15)23-8-9-25-20)21(27)26-16-6-7-24-19(12-16)28-13-14-4-2-1-3-5-14/h1-12H,13H2,(H,24,26,27)
InChIKeyRGUVQDKSLSEZHQ-UHFFFAOYSA-N
XLogP4.00
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.38
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-chloro-4-(pyridin-3-ylmethoxy)phenyl]-7-fluoroquinoxaline-5-carboxamide
CID 112845425
7-fluoro-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]quinoxaline-5-carboxamide
CID 112844532
N-(4-butylphenyl)-7-fluoroquinoxaline-5-carboxamide
CID 112844513
methyl 1-[(2-phenylmethoxy-4-pyridinyl)carbamoyl]cyclopropane-1-carboxylate
CID 119051586
(2S)-N,N-dimethyl-2-[(2-phenylmethoxy-4-pyridinyl)carbamoylamino]propanamide
CID 122159596
1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-(2-phenylmethoxy-4-pyridinyl)urea
CID 122159595
N-[(2-phenylmethoxy-4-pyridinyl)methyl]benzamide
CID 46466541
7-fluoro-N-(naphthalen-1-ylmethyl)quinoxaline-5-carboxamide
CID 112845243
2-phenylmethoxy-N,4-dipyridin-4-ylbenzamide
CID 135143390
N-(3-fluorophenyl)-2,4-bis(phenylmethoxy)benzamide
CID 69250543
N-methoxy-2-phenylmethoxypyridine-4-carboxamide
CID 47366546
N-ethyl-2-phenylmethoxypyridine-4-carboxamide
CID 47366269

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide?
The IUPAC name of 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide (CID 166179906) is 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide.
What is the SMILES notation for 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide?
The canonical SMILES for 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide is O=C(Nc1ccnc(OCc2ccccc2)c1)c1cc(F)cc2nccnc12.
What is the InChIKey of 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide?
The InChIKey is RGUVQDKSLSEZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15FN4O2/c22-15-10-17(20-18(11-15)23-8-9-25-20)21(27)26-16-6-7-24-19(12-16)28-13-14-4-2-1-3-5-14/h1-12H,13H2,(H,24,26,27).
What are the key properties of 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide?
7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide has a molecular weight of 374.38 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N-(2-phenylmethoxy-4-pyridinyl)quinoxaline-5-carboxamide is sourced from PubChem (CID 166179906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).