3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide

C16H13N5O2 — CID 58349120

IUPAC3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide
SMILESCc1cccc(C(=O)Nc2cncc(Oc3cncnc3)n2)c1
InChIInChI=1S/C16H13N5O2/c1-11-3-2-4-12(5-11)16(22)21-14-8-17-9-15(20-14)23-13-6-18-10-19-7-13/h2-10H,1H3,(H,20,21,22)
InChIKeyBUBJHGRJCKENAV-UHFFFAOYSA-N
MW307.31 g/mol
LogP2.62
Rot. Bonds4

About 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide

3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide (PubChem CID 58349120) has the molecular formula C16H13N5O2 and a molecular weight of 307.31 g/mol. Its IUPAC name is 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide.

Molecular Properties

Compound Name3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide
PubChem CID58349120
Molecular FormulaC16H13N5O2
Molecular Weight307.31 g/mol
Exact Mass307.11
IUPAC Name3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide
SMILESCc1cccc(C(=O)Nc2cncc(Oc3cncnc3)n2)c1
InChIInChI=1S/C16H13N5O2/c1-11-3-2-4-12(5-11)16(22)21-14-8-17-9-15(20-14)23-13-6-18-10-19-7-13/h2-10H,1H3,(H,20,21,22)
InChIKeyBUBJHGRJCKENAV-UHFFFAOYSA-N
XLogP2.62
TPSA89.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.31
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-fluoro-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide
CID 118707792
3-cyano-N-[6-[(6-methyl-3-pyridinyl)oxy]pyrazin-2-yl]benzamide
CID 58349077
N-(3-fluoro-5-pyrimidin-5-yloxyphenyl)-3-methylbenzamide;3-methyl-N-(3-pyrimidin-5-yloxyphenyl)benzamide
CID 123377102
3-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 966005
N-[5-[ethyl(pyrimidin-5-yl)amino]-3-pyridinyl]-3-ethynylbenzamide;N-[5-[ethyl(pyrimidin-5-yl)amino]-3-pyridinyl]-3-methylbenzamide;5-ethynyl-2-fluoro-N-(5-pyrimidin-5-yloxy-3-pyridinyl)benzamide;3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]pyrazin-2-yl]benzamide
CID 123901493
5-methyl-N-(5-pyrimidin-5-yloxy-3-pyridinyl)pyridine-3-carboxamide
CID 58349141
N-[6-[(3aR,6aS)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]pyrazin-2-yl]-3-methylbenzamide
CID 44516295
3-ethynyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]-2-pyridinyl]benzamide;bis(3-methyl-N-(6-pyridin-3-yloxy-2-pyridinyl)benzamide);3-methyl-N-[6-[[6-(trifluoromethyl)-3-pyridinyl]oxy]-2-pyridinyl]benzamide
CID 123844898
N-(5-bromo-3-pyridinyl)-3-methylbenzamide
CID 110869014
N-(5-chloropyrazin-2-yl)-3-methylbenzamide
CID 104964166
3-methyl-N-(1,2-oxazol-3-yl)benzamide
CID 17217691
ethane;3-methyl-N-pyridin-3-ylbenzamide
CID 145409327

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide?
The IUPAC name of 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide (CID 58349120) is 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide.
What is the SMILES notation for 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide?
The canonical SMILES for 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide is Cc1cccc(C(=O)Nc2cncc(Oc3cncnc3)n2)c1.
What is the InChIKey of 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide?
The InChIKey is BUBJHGRJCKENAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N5O2/c1-11-3-2-4-12(5-11)16(22)21-14-8-17-9-15(20-14)23-13-6-18-10-19-7-13/h2-10H,1H3,(H,20,21,22).
What are the key properties of 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide?
3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide has a molecular weight of 307.31 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(6-pyrimidin-5-yloxypyrazin-2-yl)benzamide is sourced from PubChem (CID 58349120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).