N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide

C20H14N8O — CID 73442523

IUPACN-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide
SMILESO=C(Nc1ccncc1)c1ccc(Nc2nc3ccccc3n3nnnc23)cc1
InChIInChI=1S/C20H14N8O/c29-20(23-15-9-11-21-12-10-15)13-5-7-14(8-6-13)22-18-19-25-26-27-28(19)17-4-2-1-3-16(17)24-18/h1-12H,(H,22,24)(H,21,23,29)
InChIKeyOASPWJIENYKJLW-UHFFFAOYSA-N
MW382.39 g/mol
LogP3.06
Rot. Bonds4

About N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide

N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide (PubChem CID 73442523) has the molecular formula C20H14N8O and a molecular weight of 382.39 g/mol. Its IUPAC name is N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide.

Molecular Properties

Compound NameN-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide
PubChem CID73442523
Molecular FormulaC20H14N8O
Molecular Weight382.39 g/mol
Exact Mass382.13
IUPAC NameN-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide
SMILESO=C(Nc1ccncc1)c1ccc(Nc2nc3ccccc3n3nnnc23)cc1
InChIInChI=1S/C20H14N8O/c29-20(23-15-9-11-21-12-10-15)13-5-7-14(8-6-13)22-18-19-25-26-27-28(19)17-4-2-1-3-16(17)24-18/h1-12H,(H,22,24)(H,21,23,29)
InChIKeyOASPWJIENYKJLW-UHFFFAOYSA-N
XLogP3.06
TPSA109.99 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.39
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

N-[4-(pyridin-4-ylmethyl)phenyl]tetrazolo[1,5-a]quinoxalin-4-amine
CID 166319969
N-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenyl]morpholine-4-carboxamide
CID 73442469
3-pyrrolidin-1-yl-N-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenyl]propanamide
CID 73441847
cyclopropyl-[4-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzoyl]piperazin-1-yl]methanone
CID 73441895
3-oxa-8-azabicyclo[3.2.1]octan-8-yl-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenyl]methanone
CID 90082714
1-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzoyl]piperidine-4-carboxylic acid
CID 73442170
1,4-diazepan-1-yl-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenyl]methanone
CID 73442117
(4-pyridin-2-ylpiperazin-1-yl)-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenyl]methanone
CID 22432629
ethane;molecular hydrogen;1-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzoyl]piperidin-4-one
CID 144591402
N-(2-methoxyethyl)-N-methyl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide;molecular hydrogen;propane
CID 144591482
2-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenol
CID 135458511
[4-(1-methylimidazole-4-carbonyl)piperazin-1-yl]-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenyl]methanone
CID 73388373

Frequently Asked Questions

What is the IUPAC name of N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide?
The IUPAC name of N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide (CID 73442523) is N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide.
What is the SMILES notation for N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide?
The canonical SMILES for N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide is O=C(Nc1ccncc1)c1ccc(Nc2nc3ccccc3n3nnnc23)cc1.
What is the InChIKey of N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide?
The InChIKey is OASPWJIENYKJLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N8O/c29-20(23-15-9-11-21-12-10-15)13-5-7-14(8-6-13)22-18-19-25-26-27-28(19)17-4-2-1-3-16(17)24-18/h1-12H,(H,22,24)(H,21,23,29).
What are the key properties of N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide?
N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide has a molecular weight of 382.39 g/mol, XLogP of 3.06, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-4-yl-4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)benzamide is sourced from PubChem (CID 73442523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).